[4-(2-methyl-4-nitro-phenyl)piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-(2-methyl-4-nitro-phenyl)piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(2-methyl-4-nitro-phenyl)piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-(2-methyl-4-nitrophenyl)-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-(2-methyl-4-nitrophenyl)piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(2-methyl-4-nitro-phenyl)piperazino]-(2-thienyl)methanone Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O3S/c1-12-11-13(19(21)22)4-5-14(12)17-6-8-18(9-7-17)16(20)15-3-2-10-23-15/h2-5,10-11H,6-9H2,1H3