5-[methyl-[(2-phenylsulfanylpyridin-4-yl)methyl]amino]-8-nitro-naphthalene-1-carbonitrile

Systemtic Name: 5-[methyl-[(2-phenylsulfanylpyridin-4-yl)methyl]amino]-8-nitro-naphthalene-1-carbonitrile Openeye Name: 5-[methyl-[(2-phenylsulfanyl-4-pyridyl)methyl]amino]-8-nitro-naphthalene-1-carbonitrile CAS Name: 5-[methyl-[[2-(phenylthio)-4-pyridinyl]methyl]amino]-8-nitro-1-naphthalenecarbonitrile IUPAC Name: 5-[methyl-[(2-phenylsulfanylpyridin-4-yl)methyl]amino]-8-nitronaphthalene-1-carbonitrile Traditional Name: 5-[methyl-[[2-(phenylthio)-4-pyridyl]methyl]amino]-8-nitro-naphthalene-1-carbonitrile Formula: C24H18N4O2S MolecularWeight: 426.49032

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=NC=C1)SC2=CC=CC=C2)C3=CC=C(C4=C(C=CC=C34)C#N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC(=NC=C1)SC2=CC=CC=C2)C3=CC=C(C4=C(C=CC=C34)C#N)[N+](=O)[O-]

InChI

InChI=1S/C24H18N4O2S/c1-27(16-17-12-13-26-23(14-17)31-19-7-3-2-4-8-19)21-10-11-22(28(29)30)24-18(15-25)6-5-9-20(21)24/h2-14H,16H2,1H3