1-{5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-3-carboxylic acid

CAS: 1142210-30-7

Formula: C17H18N4O5S

SMILES: COC1=CC=C(NC(=O)C2=NN=C(S2)C(=O)N2CCCC(C2)C(O)=O)C=C1

IUPAC: 1-{5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-3-carboxylic acid

InChI: InChI=1/C17H18N4O5S/c1-26-12-6-4-11(5-7-12)18-13(22)14-19-20-15(27-14)16(23)21-8-2-3-10(9-21)17(24)25/h4-7,10H,2-3,8-9H2,1H3,(H,18,22)(H,24,25)

Composition: C (52.30%), H (4.65%), N (14.35%), O (20.49%), S (8.21%)

Molar Mass: 390.41

Atom Count: 45

Heavy Atom Count: 27