2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-N-(phenylmethyl)butanamide

Systemtic Name: 2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-butanamide CAS Name: 2-[(1-methyl-5-phenyl-2-imidazolyl)thio]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-2-(1-methyl-5-phenylimidazol-2-yl)sulfanylbutanamide Traditional Name: N-benzyl-2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]butyramide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NC=C(N2C)C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NC=C(N2C)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3OS/c1-3-19(20(25)22-14-16-10-6-4-7-11-16)26-21-23-15-18(24(21)2)17-12-8-5-9-13-17/h4-13,15,19H,3,14H2,1-2H3,(H,22,25)