4-cyclohexylsulfanyl-3-nitro-N-pyridin-2-yl-benzamide

Systemtic Name: 4-cyclohexylsulfanyl-3-nitro-N-pyridin-2-yl-benzamide Openeye Name: 4-cyclohexylsulfanyl-3-nitro-N-(2-pyridyl)benzamide CAS Name: 4-(cyclohexylthio)-3-nitro-N-(2-pyridinyl)benzamide IUPAC Name: 4-cyclohexylsulfanyl-3-nitro-N-pyridin-2-ylbenzamide Traditional Name: 4-(cyclohexylthio)-3-nitro-N-(2-pyridyl)benzamide Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=C(C=C(C=C2)C(=O)NC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)SC2=C(C=C(C=C2)C(=O)NC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3S/c22-18(20-17-8-4-5-11-19-17)13-9-10-16(15(12-13)21(23)24)25-14-6-2-1-3-7-14/h4-5,8-12,14H,1-3,6-7H2,(H,19,20,22)