N-(2-phenylpropyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(2-phenylpropyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Openeye Name: N-(2-phenylpropyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide CAS Name: N-(2-phenylpropyl)-1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-3-piperidinecarboxamide IUPAC Name: N-(2-phenylpropyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Traditional Name: N-(2-phenylpropyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)nipecotamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1CCCN(C1)C2=NN=C(S2)N3C=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)C1CCCN(C1)C2=NN=C(S2)N3C=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N5OS/c1-16(17-8-3-2-4-9-17)14-22-19(27)18-10-7-13-26(15-18)21-24-23-20(28-21)25-11-5-6-12-25/h2-6,8-9,11-12,16,18H,7,10,13-15H2,1H3,(H,22,27)