N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-[4-(p-tolyl)thiazol-2-yl]benzothiophene-2-carboxamide CAS Name: N-[4-(4-methylphenyl)-2-thiazolyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-[4-(p-tolyl)thiazol-2-yl]benzothiophene-2-carboxamide Formula: C19H13N3O3S2 MolecularWeight: 395.45482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O3S2/c1-11-2-4-12(5-3-11)15-10-26-19(20-15)21-18(23)17-9-13-8-14(22(24)25)6-7-16(13)27-17/h2-10H,1H3,(H,20,21,23)