(E)-N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(3-methoxy-4-propan-2-yloxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(3-methoxy-4-propan-2-yloxy-phenyl)prop-2-enamide Openeye Name: (E)-N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(4-isopropoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(3-methoxy-4-propan-2-yloxyphenyl)-2-propenamide IUPAC Name: (E)-N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide Traditional Name: (E)-N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(4-isopropoxy-3-methoxy-phenyl)acrylamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C=CC(=O)NC(CCSC)C2=NC3=CC=CC=C3N2)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)/C=C/C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2)OC

InChI

InChI=1S/C24H29N3O3S/c1-16(2)30-21-11-9-17(15-22(21)29-3)10-12-23(28)25-20(13-14-31-4)24-26-18-7-5-6-8-19(18)27-24/h5-12,15-16,20H,13-14H2,1-4H3,(H,25,28)(H,26,27)/b12-10+