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

Systemtic Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-5-nitro-thiophene-2-carboxamide Openeye Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-5-nitro-thiophene-2-carboxamide CAS Name: N-[4-(2,4-dimethylphenyl)-2-thiazolyl]-5-nitro-2-thiophenecarboxamide IUPAC Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-5-nitrothiophene-2-carboxamide Traditional Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-5-nitro-thiophene-2-carboxamide Formula: C16H13N3O3S2 MolecularWeight: 359.42272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O3S2/c1-9-3-4-11(10(2)7-9)12-8-23-16(17-12)18-15(20)13-5-6-14(24-13)19(21)22/h3-8H,1-2H3,(H,17,18,20)