(3-methylpiperidin-1-yl)-[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-phenyl]methanone

Systemtic Name: (3-methylpiperidin-1-yl)-[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-phenyl]methanone Openeye Name: (3-methyl-1-piperidyl)-[4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-phenyl]methanone CAS Name: (3-methyl-1-piperidinyl)-[4-[(4-methyl-2-thiazolyl)thio]-3-nitrophenyl]methanone IUPAC Name: (3-methylpiperidin-1-yl)-[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrophenyl]methanone Traditional Name: (3-methylpiperidino)-[4-[(4-methylthiazol-2-yl)thio]-3-nitro-phenyl]methanone Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)SC3=NC(=CS3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)SC3=NC(=CS3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3S2/c1-11-4-3-7-19(9-11)16(21)13-5-6-15(14(8-13)20(22)23)25-17-18-12(2)10-24-17/h5-6,8,10-11H,3-4,7,9H2,1-2H3