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

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-N-(phenylmethyl)thiophene-2-carboxamide Openeye Name: N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-N-(phenylmethyl)-2-thiophenecarboxamide IUPAC Name: N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)-5-nitrothiophene-2-carboxamide Traditional Name: N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide Formula: C20H15N3O3S2 MolecularWeight: 409.4814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O3S2/c1-13-6-5-9-15-18(13)21-20(28-15)22(12-14-7-3-2-4-8-14)19(24)16-10-11-17(27-16)23(25)26/h2-11H,12H2,1H3