1-(3,3-dimethyl-7-nitro-4H-naphthalen-1-yl)pyridine-2-thione

Systemtic Name: 1-(3,3-dimethyl-7-nitro-4H-naphthalen-1-yl)pyridine-2-thione Openeye Name: 1-(3,3-dimethyl-7-nitro-4H-naphthalen-1-yl)pyridine-2-thione CAS Name: 1-(3,3-dimethyl-7-nitro-4H-naphthalen-1-yl)-2-pyridinethione IUPAC Name: 1-(3,3-dimethyl-7-nitro-4H-naphthalen-1-yl)pyridine-2-thione Traditional Name: 1-(3,3-dimethyl-7-nitro-4H-naphthalen-1-yl)pyridine-2-thione Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=C(C=C2)[N+](=O)[O-])C(=C1)N3C=CC=CC3=S)C

Isomeric SMILES

CC1(CC2=C(C=C(C=C2)[N+](=O)[O-])C(=C1)N3C=CC=CC3=S)C

InChI

InChI=1S/C17H16N2O2S/c1-17(2)10-12-6-7-13(19(20)21)9-14(12)15(11-17)18-8-4-3-5-16(18)22/h3-9,11H,10H2,1-2H3