3-nitro-N-[(4-nitrophenyl)carbamothioyl]-4-piperidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-[(4-nitrophenyl)carbamothioyl]-4-piperidin-1-yl-benzamide Openeye Name: 3-nitro-N-[(4-nitrophenyl)carbamothioyl]-4-(1-piperidyl)benzamide CAS Name: 3-nitro-N-[(4-nitroanilino)-sulfanylidenemethyl]-4-(1-piperidinyl)benzamide IUPAC Name: 3-nitro-N-[(4-nitrophenyl)carbamothioyl]-4-piperidin-1-ylbenzamide Traditional Name: 3-nitro-N-[(4-nitrophenyl)thiocarbamoyl]-4-piperidino-benzamide Formula: C19H19N5O5S MolecularWeight: 429.44966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O5S/c25-18(21-19(30)20-14-5-7-15(8-6-14)23(26)27)13-4-9-16(17(12-13)24(28)29)22-10-2-1-3-11-22/h4-9,12H,1-3,10-11H2,(H2,20,21,25,30)