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

Systemtic Name: N-[4-(4-methoxy-3-methyl-phenyl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[4-(4-methoxy-3-methyl-phenyl)thiazol-2-yl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[4-(4-methoxy-3-methylphenyl)-2-thiazolyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-(4-methoxy-3-methylphenyl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[4-(4-methoxy-3-methyl-phenyl)thiazol-2-yl]-5-nitro-benzothiophene-2-carboxamide Formula: C20H15N3O4S2 MolecularWeight: 425.4808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O4S2/c1-11-7-12(3-5-16(11)27-2)15-10-28-20(21-15)22-19(24)18-9-13-8-14(23(25)26)4-6-17(13)29-18/h3-10H,1-2H3,(H,21,22,24)