N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(4-chlorophenyl)-(1-methyl-2-imidazolyl)methyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-5-nitro-benzothiophene-2-carboxamide Formula: C20H15ClN4O3S MolecularWeight: 426.8761

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=C(C=C2)Cl)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1C(C2=CC=C(C=C2)Cl)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15ClN4O3S/c1-24-9-8-22-19(24)18(12-2-4-14(21)5-3-12)23-20(26)17-11-13-10-15(25(27)28)6-7-16(13)29-17/h2-11,18H,1H3,(H,23,26)