2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-(phenylmethyl)butanamide

Systemtic Name: 2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-2-(1-cyclopropylimidazol-2-yl)sulfanyl-butanamide CAS Name: 2-[(1-cyclopropyl-2-imidazolyl)thio]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-2-(1-cyclopropylimidazol-2-yl)sulfanylbutanamide Traditional Name: N-benzyl-2-[(1-cyclopropylimidazol-2-yl)thio]butyramide Formula: C17H21N3OS MolecularWeight: 315.43314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NC=CN2C3CC3

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NC=CN2C3CC3

InChI

InChI=1S/C17H21N3OS/c1-2-15(16(21)19-12-13-6-4-3-5-7-13)22-17-18-10-11-20(17)14-8-9-14/h3-7,10-11,14-15H,2,8-9,12H2,1H3,(H,19,21)