N-[(4-chlorophenyl)-phenyl-methyl]-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-chlorophenyl)-phenyl-methyl]-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4-chlorophenyl)-phenyl-methyl]-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(4-chlorophenyl)-phenylmethyl]-2-[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[(4-chlorophenyl)-phenylmethyl]-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(4-chlorophenyl)-phenyl-methyl]-2-[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]acetamide Formula: C24H26ClN5OS MolecularWeight: 468.01414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(N2C3CC3)SCC(=O)NC(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(C1)C2=NN=C(N2C3CC3)SCC(=O)NC(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C24H26ClN5OS/c25-19-10-8-18(9-11-19)22(17-6-2-1-3-7-17)26-21(31)16-32-24-28-27-23(29-14-4-5-15-29)30(24)20-12-13-20/h1-3,6-11,20,22H,4-5,12-16H2,(H,26,31)