4-(cyclopropylamino)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O3S/c1-10-3-2-4-15-16(10)20-18(26-15)21-17(23)11-5-8-13(19-12-6-7-12)14(9-11)22(24)25/h2-5,8-9,12,19H,6-7H2,1H3,(H,20,21,23)