N-[2-[[4-methyl-2-(phenylcarbonyl)phenyl]carbamoyl]phenyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-[[4-methyl-2-(phenylcarbonyl)phenyl]carbamoyl]phenyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[2-[(2-benzoyl-4-methyl-phenyl)carbamoyl]phenyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[2-[(2-benzoyl-4-methylanilino)-oxomethyl]phenyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-[(2-benzoyl-4-methylphenyl)carbamoyl]phenyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-[(2-benzoyl-4-methyl-phenyl)carbamoyl]phenyl]-5-nitro-benzothiophene-2-carboxamide Formula: C30H21N3O5S MolecularWeight: 535.56984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])C(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H21N3O5S/c1-18-11-13-25(23(15-18)28(34)19-7-3-2-4-8-19)31-29(35)22-9-5-6-10-24(22)32-30(36)27-17-20-16-21(33(37)38)12-14-26(20)39-27/h2-17H,1H3,(H,31,35)(H,32,36)