3-chloranyl-N-(4-methylphenyl)-N-[(4-nitrophenyl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(4-methylphenyl)-N-[(4-nitrophenyl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(4-nitrophenyl)methyl]-N-(p-tolyl)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(4-methylphenyl)-N-[(4-nitrophenyl)methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(4-methylphenyl)-N-[(4-nitrophenyl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(4-nitrobenzyl)-N-(p-tolyl)benzothiophene-2-carboxamide Formula: C23H17ClN2O3S MolecularWeight: 436.91068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C23H17ClN2O3S/c1-15-6-10-17(11-7-15)25(14-16-8-12-18(13-9-16)26(28)29)23(27)22-21(24)19-4-2-3-5-20(19)30-22/h2-13H,14H2,1H3