[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(5-methyl-4-nitro-thiophen-2-yl)methanone

Systemtic Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(5-methyl-4-nitro-thiophen-2-yl)methanone Openeye Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(5-methyl-4-nitro-2-thienyl)methanone CAS Name: [4-[(4-chlorophenyl)methyl]-1-piperazinyl]-(5-methyl-4-nitro-2-thiophenyl)methanone IUPAC Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(5-methyl-4-nitrothiophen-2-yl)methanone Traditional Name: [4-(4-chlorobenzyl)piperazino]-(5-methyl-4-nitro-2-thienyl)methanone Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H18ClN3O3S/c1-12-15(21(23)24)10-16(25-12)17(22)20-8-6-19(7-9-20)11-13-2-4-14(18)5-3-13/h2-5,10H,6-9,11H2,1H3