N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-4-phenyl-1H-imidazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-4-phenyl-1H-imidazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-4-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-4-phenyl-1H-imidazol-2-yl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-4-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide Traditional Name: 2-[(5-methyl-4-phenyl-1H-imidazol-2-yl)thio]-N-piperonyl-acetamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C20H19N3O3S/c1-13-19(15-5-3-2-4-6-15)23-20(22-13)27-11-18(24)21-10-14-7-8-16-17(9-14)26-12-25-16/h2-9H,10-12H2,1H3,(H,21,24)(H,22,23)