[4-(1,3-thiazol-2-yl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone

Systemtic Name: [4-(1,3-thiazol-2-yl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Openeye Name: (4-thiazol-2-ylpiperazin-1-yl)-(3,4,5-trimethoxy-2-nitro-phenyl)methanone CAS Name: [4-(2-thiazolyl)-1-piperazinyl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone IUPAC Name: [4-(1,3-thiazol-2-yl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone Traditional Name: (4-thiazol-2-ylpiperazino)-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Formula: C17H20N4O6S MolecularWeight: 408.4289

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)N2CCN(CC2)C3=NC=CS3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)N2CCN(CC2)C3=NC=CS3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C17H20N4O6S/c1-25-12-10-11(13(21(23)24)15(27-3)14(12)26-2)16(22)19-5-7-20(8-6-19)17-18-4-9-28-17/h4,9-10H,5-8H2,1-3H3