N-[4-(diethylamino)-2-methyl-phenyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: N-[4-(diethylamino)-2-methyl-phenyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Openeye Name: N-[4-(diethylamino)-2-methyl-phenyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide CAS Name: N-[4-(diethylamino)-2-methylphenyl]-1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-3-piperidinecarboxamide IUPAC Name: N-[4-(diethylamino)-2-methylphenyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Traditional Name: N-[4-(diethylamino)-2-methyl-phenyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)nipecotamide Formula: C23H30N6OS MolecularWeight: 438.5889

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC(=O)C2CCCN(C2)C3=NN=C(S3)N4C=CC=C4)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC(=O)C2CCCN(C2)C3=NN=C(S3)N4C=CC=C4)C

InChI

InChI=1S/C23H30N6OS/c1-4-27(5-2)19-10-11-20(17(3)15-19)24-21(30)18-9-8-14-29(16-18)23-26-25-22(31-23)28-12-6-7-13-28/h6-7,10-13,15,18H,4-5,8-9,14,16H2,1-3H3,(H,24,30)