(2S)-2-(4-nitrophenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: (2S)-2-(4-nitrophenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: (2S)-2-(4-nitrophenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: (2S)-2-[(4-nitrophenyl)thio]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: (2S)-2-(4-nitrophenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: (2S)-2-[(4-nitrophenyl)thio]-1-(4-phenylpiperazino)propan-1-one Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3S/c1-15(26-18-9-7-17(8-10-18)22(24)25)19(23)21-13-11-20(12-14-21)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3/t15-/m0/s1