4-methylsulfanyl-3-nitro-N-(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,3]thiazol-2-yl)benzamide

Systemtic Name: 4-methylsulfanyl-3-nitro-N-(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,3]thiazol-2-yl)benzamide Openeye Name: 4-methylsulfanyl-3-nitro-N-(5,6,7,8-tetrahydro-4H-cyclohepta[d]thiazol-2-yl)benzamide CAS Name: 4-(methylthio)-3-nitro-N-(5,6,7,8-tetrahydro-4H-cyclohepta[d]thiazol-2-yl)benzamide IUPAC Name: 4-methylsulfanyl-3-nitro-N-(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,3]thiazol-2-yl)benzamide Traditional Name: 4-(methylthio)-3-nitro-N-(5,6,7,8-tetrahydro-4H-cyclohepta[d]thiazol-2-yl)benzamide Formula: C16H17N3O3S2 MolecularWeight: 363.45448

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O3S2/c1-23-14-8-7-10(9-12(14)19(21)22)15(20)18-16-17-11-5-3-2-4-6-13(11)24-16/h7-9H,2-6H2,1H3,(H,17,18,20)