[4-(methylsulfanylmethyl)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(methylsulfanylmethyl)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [4-(methylsulfanylmethyl)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [4-[(methylthio)methyl]phenyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [4-(methylsulfanylmethyl)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [4-[(methylthio)methyl]phenyl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3S/c1-26-14-15-2-4-16(5-3-15)19(23)21-12-10-20(11-13-21)17-6-8-18(9-7-17)22(24)25/h2-9H,10-14H2,1H3