N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: 2-(1-allylbenzimidazol-2-yl)sulfanyl-N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-acetamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: 2-[(1-allylbenzimidazol-2-yl)thio]-N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-acetamide Formula: C22H22N4OS2 MolecularWeight: 422.56628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)CSC3=NC4=CC=CC=C4N3CC=C

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)CSC3=NC4=CC=CC=C4N3CC=C

InChI

InChI=1S/C22H22N4OS2/c1-4-13-26-18-11-7-5-9-16(18)24-22(26)28-14-20(27)25(3)15(2)21-23-17-10-6-8-12-19(17)29-21/h4-12,15H,1,13-14H2,2-3H3/t15-/m1/s1