N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide CAS Name: N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)isonipecotamide Formula: C26H35N7OS MolecularWeight: 493.6674

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3)C4=NN=C(S4)N5C=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3)C4=NN=C(S4)N5C=CC=C5

InChI

InChI=1S/C26H35N7OS/c34-24(23-9-15-33(16-10-23)26-29-28-25(35-26)32-13-4-5-14-32)27-11-6-12-30-17-19-31(20-18-30)21-22-7-2-1-3-8-22/h1-5,7-8,13-14,23H,6,9-12,15-21H2,(H,27,34)