4-(3-methylbutylsulfanyl)-3-nitro-N-(1,3-thiazol-2-yl)benzamide

Systemtic Name: 4-(3-methylbutylsulfanyl)-3-nitro-N-(1,3-thiazol-2-yl)benzamide Openeye Name: 4-isopentylsulfanyl-3-nitro-N-thiazol-2-yl-benzamide CAS Name: 4-(3-methylbutylthio)-3-nitro-N-(2-thiazolyl)benzamide IUPAC Name: 4-(3-methylbutylsulfanyl)-3-nitro-N-(1,3-thiazol-2-yl)benzamide Traditional Name: 4-(isoamylthio)-3-nitro-N-thiazol-2-yl-benzamide Formula: C15H17N3O3S2 MolecularWeight: 351.44378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=C(C=C(C=C1)C(=O)NC2=NC=CS2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCSC1=C(C=C(C=C1)C(=O)NC2=NC=CS2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O3S2/c1-10(2)5-7-22-13-4-3-11(9-12(13)18(20)21)14(19)17-15-16-6-8-23-15/h3-4,6,8-10H,5,7H2,1-2H3,(H,16,17,19)