1-cyclopropylethyl (E)-3-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-3-phenyl-prop-2-enoate

Systemtic Name: 1-cyclopropylethyl (E)-3-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-3-phenyl-prop-2-enoate Openeye Name: 1-cyclopropylethyl (E)-3-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-3-phenyl-prop-2-enoate CAS Name: (E)-3-(2-amino-3-propan-2-ylsulfonyl-5-benzimidazolyl)-3-phenyl-2-propenoic acid 1-cyclopropylethyl ester IUPAC Name: 1-cyclopropylethyl (E)-3-(2-amino-3-propan-2-ylsulfonylbenzimidazol-5-yl)-3-phenylprop-2-enoate Traditional Name: (E)-3-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-3-phenyl-acrylic acid 1-cyclopropylethyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C(=CC(=O)OC(C)C3CC3)C4=CC=CC=C4)N=C1N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)/C(=C/C(=O)OC(C)C3CC3)/C4=CC=CC=C4)N=C1N

InChI

InChI=1S/C24H27N3O4S/c1-15(2)32(29,30)27-22-13-19(11-12-21(22)26-24(27)25)20(18-7-5-4-6-8-18)14-23(28)31-16(3)17-9-10-17/h4-8,11-17H,9-10H2,1-3H3,(H2,25,26)/b20-14+