N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-(methylamino)-3-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-(methylamino)-3-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-(methylamino)-3-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-4-(methylamino)-3-nitro-benzamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)N(C)CC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)N(C)CC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O3S/c1-18-12-8-7-11(9-14(12)21(23)24)17(22)20(2)10-16-19-13-5-3-4-6-15(13)25-16/h3-9,18H,10H2,1-2H3