N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-5-nitro-N-(phenylmethyl)thiophene-2-carboxamide

Systemtic Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-5-nitro-N-(phenylmethyl)thiophene-2-carboxamide Openeye Name: N-benzyl-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide CAS Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-5-nitro-N-(phenylmethyl)-2-thiophenecarboxamide IUPAC Name: N-benzyl-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-5-nitrothiophene-2-carboxamide Traditional Name: N-benzyl-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide Formula: C21H17N3O4S2 MolecularWeight: 439.50738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O4S2/c1-13-8-9-15(28-2)18-19(13)30-21(22-18)23(12-14-6-4-3-5-7-14)20(25)16-10-11-17(29-16)24(26)27/h3-11H,12H2,1-2H3