N-phenethyl-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)propanamide

Systemtic Name: N-phenethyl-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)propanamide Openeye Name: 2-(2-isopropylsulfanylbenzimidazol-1-yl)-N-phenethyl-propanamide CAS Name: N-phenethyl-2-[2-(propan-2-ylthio)-1-benzimidazolyl]propanamide IUPAC Name: N-phenethyl-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)propanamide Traditional Name: 2-[2-(isopropylthio)benzimidazol-1-yl]-N-phenethyl-propionamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=CC=CC=C2N1C(C)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C)SC1=NC2=CC=CC=C2N1C(C)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3OS/c1-15(2)26-21-23-18-11-7-8-12-19(18)24(21)16(3)20(25)22-14-13-17-9-5-4-6-10-17/h4-12,15-16H,13-14H2,1-3H3,(H,22,25)