(3-methyl-4-nitro-phenyl)-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone

Systemtic Name: (3-methyl-4-nitro-phenyl)-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone Openeye Name: (3-methyl-4-nitro-phenyl)-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: (3-methyl-4-nitrophenyl)-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-methyl-4-nitrophenyl)-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: (3-methyl-4-nitro-phenyl)-[4-(2-thenoyl)piperazino]methanone Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4S/c1-12-11-13(4-5-14(12)20(23)24)16(21)18-6-8-19(9-7-18)17(22)15-3-2-10-25-15/h2-5,10-11H,6-9H2,1H3