(E)-4-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-4-phenyl-but-3-en-2-one

Systemtic Name: (E)-4-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-4-phenyl-but-3-en-2-one Openeye Name: (E)-4-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-4-phenyl-but-3-en-2-one CAS Name: (E)-4-(2-amino-3-propan-2-ylsulfonyl-5-benzimidazolyl)-4-phenyl-3-buten-2-one IUPAC Name: (E)-4-(2-amino-3-propan-2-ylsulfonylbenzimidazol-5-yl)-4-phenylbut-3-en-2-one Traditional Name: (E)-4-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-4-phenyl-but-3-en-2-one Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S/c1-13(2)27(25,26)23-19-12-16(9-10-18(19)22-20(23)21)17(11-14(3)24)15-7-5-4-6-8-15/h4-13H,1-3H3,(H2,21,22)/b17-11+