4-methyl-N-[4-[(4-nitrophenyl)amino]sulfanylphenyl]piperazine-1-carboxamide

Systemtic Name: 4-methyl-N-[4-[(4-nitrophenyl)amino]sulfanylphenyl]piperazine-1-carboxamide Openeye Name: 4-methyl-N-[4-(4-nitroanilino)sulfanylphenyl]piperazine-1-carboxamide CAS Name: 4-methyl-N-[4-[(4-nitroanilino)thio]phenyl]-1-piperazinecarboxamide IUPAC Name: 4-methyl-N-[4-(4-nitroanilino)sulfanylphenyl]piperazine-1-carboxamide Traditional Name: 4-methyl-N-[4-[(4-nitroanilino)thio]phenyl]piperazine-1-carboxamide Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)NC2=CC=C(C=C2)SNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)NC2=CC=C(C=C2)SNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O3S/c1-21-10-12-22(13-11-21)18(24)19-14-4-8-17(9-5-14)27-20-15-2-6-16(7-3-15)23(25)26/h2-9,20H,10-13H2,1H3,(H,19,24)