N-(2-methylindolizin-3-yl)carbothioyl-4-nitro-benzamide

Systemtic Name: N-(2-methylindolizin-3-yl)carbothioyl-4-nitro-benzamide Openeye Name: N-(2-methylindolizine-3-carbothioyl)-4-nitro-benzamide CAS Name: N-[(2-methyl-3-indolizinyl)-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-(2-methylindolizine-3-carbothioyl)-4-nitrobenzamide Traditional Name: N-(2-methylindolizine-3-carbothioyl)-4-nitro-benzamide Formula: C17H13N3O3S MolecularWeight: 339.36842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=CC=CC2=C1)C(=S)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N2C=CC=CC2=C1)C(=S)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O3S/c1-11-10-14-4-2-3-9-19(14)15(11)17(24)18-16(21)12-5-7-13(8-6-12)20(22)23/h2-10H,1H3,(H,18,21,24)