N-[2-(2-azanylethylsulfanyl)-3-(3-methylbut-2-enyl)benzimidazol-5-yl]benzamide

Systemtic Name: N-[2-(2-azanylethylsulfanyl)-3-(3-methylbut-2-enyl)benzimidazol-5-yl]benzamide Openeye Name: N-[2-(2-aminoethylsulfanyl)-3-(3-methylbut-2-enyl)benzimidazol-5-yl]benzamide CAS Name: N-[2-(2-aminoethylthio)-3-(3-methylbut-2-enyl)-5-benzimidazolyl]benzamide IUPAC Name: N-[2-(2-aminoethylsulfanyl)-3-(3-methylbut-2-enyl)benzimidazol-5-yl]benzamide Traditional Name: N-[2-(2-aminoethylthio)-3-(3-methylbut-2-enyl)benzimidazol-5-yl]benzamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3)N=C1SCCN)C

Isomeric SMILES

CC(=CCN1C2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3)N=C1SCCN)C

InChI

InChI=1S/C21H24N4OS/c1-15(2)10-12-25-19-14-17(23-20(26)16-6-4-3-5-7-16)8-9-18(19)24-21(25)27-13-11-22/h3-10,14H,11-13,22H2,1-2H3,(H,23,26)