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

Systemtic Name: N-[4-(4-methylphenyl)-5-(4-nitrophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide Openeye Name: N-[5-(4-nitrophenyl)-4-(p-tolyl)thiazol-2-yl]thiophene-2-carboxamide CAS Name: N-[4-(4-methylphenyl)-5-(4-nitrophenyl)-2-thiazolyl]-2-thiophenecarboxamide IUPAC Name: N-[4-(4-methylphenyl)-5-(4-nitrophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide Traditional Name: N-[5-(4-nitrophenyl)-4-(p-tolyl)thiazol-2-yl]thiophene-2-carboxamide Formula: C21H15N3O3S2 MolecularWeight: 421.4921

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O3S2/c1-13-4-6-14(7-5-13)18-19(15-8-10-16(11-9-15)24(26)27)29-21(22-18)23-20(25)17-3-2-12-28-17/h2-12H,1H3,(H,22,23,25)