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

Systemtic Name: cyclopropylmethyl (E)-3-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-3-phenyl-prop-2-enoate Openeye Name: cyclopropylmethyl (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 cyclopropylmethyl ester IUPAC Name: cyclopropylmethyl (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 cyclopropylmethyl ester Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C(=CC(=O)OCC3CC3)C4=CC=CC=C4)N=C1N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)/C(=C/C(=O)OCC3CC3)/C4=CC=CC=C4)N=C1N

InChI

InChI=1S/C23H25N3O4S/c1-15(2)31(28,29)26-21-12-18(10-11-20(21)25-23(26)24)19(17-6-4-3-5-7-17)13-22(27)30-14-16-8-9-16/h3-7,10-13,15-16H,8-9,14H2,1-2H3,(H2,24,25)/b19-13+