(Z)-3-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enamide

Systemtic Name: (Z)-3-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enamide Openeye Name: (Z)-3-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-3-(3-fluoro-4-methoxy-phenyl)prop-2-enamide CAS Name: (Z)-3-(2-amino-3-propan-2-ylsulfonyl-5-benzimidazolyl)-3-(3-fluoro-4-methoxyphenyl)-2-propenamide IUPAC Name: (Z)-3-(2-amino-3-propan-2-ylsulfonylbenzimidazol-5-yl)-3-(3-fluoro-4-methoxyphenyl)prop-2-enamide Traditional Name: (Z)-3-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-3-(3-fluoro-4-methoxy-phenyl)acrylamide Formula: C20H21FN4O4S MolecularWeight: 432.468543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C(=CC(=O)N)C3=CC(=C(C=C3)OC)F)N=C1N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)/C(=C/C(=O)N)/C3=CC(=C(C=C3)OC)F)N=C1N

InChI

InChI=1S/C20H21FN4O4S/c1-11(2)30(27,28)25-17-9-13(4-6-16(17)24-20(25)23)14(10-19(22)26)12-5-7-18(29-3)15(21)8-12/h4-11H,1-3H3,(H2,22,26)(H2,23,24)/b14-10+