3-[(E)-3-[4-(2-bromophenyl)sulfanyl-3-chloranyl-phenyl]prop-2-enoyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[(E)-3-[4-(2-bromophenyl)sulfanyl-3-chloranyl-phenyl]prop-2-enoyl]-1H-benzimidazol-2-one Openeye Name: 3-[(E)-3-[4-(2-bromophenyl)sulfanyl-3-chloro-phenyl]prop-2-enoyl]-1H-benzimidazol-2-one CAS Name: 3-[(E)-3-[4-[(2-bromophenyl)thio]-3-chlorophenyl]-1-oxoprop-2-enyl]-1H-benzimidazol-2-one IUPAC Name: 3-[(E)-3-[4-(2-bromophenyl)sulfanyl-3-chlorophenyl]prop-2-enoyl]-1H-benzimidazol-2-one Traditional Name: 3-[(E)-3-[4-[(2-bromophenyl)thio]-3-chloro-phenyl]acryloyl]-1H-benzimidazol-2-one Formula: C22H14BrClN2O2S MolecularWeight: 485.78076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2C(=O)C=CC3=CC(=C(C=C3)SC4=CC=CC=C4Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2C(=O)/C=C/C3=CC(=C(C=C3)SC4=CC=CC=C4Br)Cl

InChI

InChI=1S/C22H14BrClN2O2S/c23-15-5-1-4-8-19(15)29-20-11-9-14(13-16(20)24)10-12-21(27)26-18-7-3-2-6-17(18)25-22(26)28/h1-13H,(H,25,28)/b12-10+