5-(1H-benzimidazol-2-ylsulfanyl)-2-piperazin-1-yl-N-[2,4,6-tri(propan-2-yl)phenyl]pentanamide

Systemtic Name: 5-(1H-benzimidazol-2-ylsulfanyl)-2-piperazin-1-yl-N-[2,4,6-tri(propan-2-yl)phenyl]pentanamide Openeye Name: 5-(1H-benzimidazol-2-ylsulfanyl)-2-piperazin-1-yl-N-(2,4,6-triisopropylphenyl)pentanamide CAS Name: 5-(1H-benzimidazol-2-ylthio)-2-(1-piperazinyl)-N-[2,4,6-tri(propan-2-yl)phenyl]pentanamide IUPAC Name: 5-(1H-benzimidazol-2-ylsulfanyl)-2-piperazin-1-yl-N-[2,4,6-tri(propan-2-yl)phenyl]pentanamide Traditional Name: 5-(1H-benzimidazol-2-ylthio)-2-piperazino-N-(2,4,6-triisopropylphenyl)valeramide Formula: C31H45N5OS MolecularWeight: 535.7869

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)NC(=O)C(CCCSC2=NC3=CC=CC=C3N2)N4CCNCC4)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)NC(=O)C(CCCSC2=NC3=CC=CC=C3N2)N4CCNCC4)C(C)C

InChI

InChI=1S/C31H45N5OS/c1-20(2)23-18-24(21(3)4)29(25(19-23)22(5)6)35-30(37)28(36-15-13-32-14-16-36)12-9-17-38-31-33-26-10-7-8-11-27(26)34-31/h7-8,10-11,18-22,28,32H,9,12-17H2,1-6H3,(H,33,34)(H,35,37)