[4-[(6-azanyl-5-nitro-pyridin-2-yl)amino]-2-chloranyl-phenyl]-(2-methylphenyl)methanethione

Systemtic Name: [4-[(6-azanyl-5-nitro-pyridin-2-yl)amino]-2-chloranyl-phenyl]-(2-methylphenyl)methanethione Openeye Name: [4-[(6-amino-5-nitro-2-pyridyl)amino]-2-chloro-phenyl]-(o-tolyl)methanethione CAS Name: [4-[(6-amino-5-nitro-2-pyridinyl)amino]-2-chlorophenyl]-(2-methylphenyl)methanethione IUPAC Name: [4-[(6-amino-5-nitropyridin-2-yl)amino]-2-chlorophenyl]-(2-methylphenyl)methanethione Traditional Name: [4-[(6-amino-5-nitro-2-pyridyl)amino]-2-chloro-phenyl]-(o-tolyl)methanethione Formula: C19H15ClN4O2S MolecularWeight: 398.866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=S)C2=C(C=C(C=C2)NC3=NC(=C(C=C3)[N+](=O)[O-])N)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=S)C2=C(C=C(C=C2)NC3=NC(=C(C=C3)[N+](=O)[O-])N)Cl

InChI

InChI=1S/C19H15ClN4O2S/c1-11-4-2-3-5-13(11)18(27)14-7-6-12(10-15(14)20)22-17-9-8-16(24(25)26)19(21)23-17/h2-10H,1H3,(H3,21,22,23)