3-nitro-N-[(2-oxidanylnaphthalen-1-yl)carbamothioyl]-4-piperidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-[(2-oxidanylnaphthalen-1-yl)carbamothioyl]-4-piperidin-1-yl-benzamide Openeye Name: N-[(2-hydroxy-1-naphthyl)carbamothioyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[[(2-hydroxy-1-naphthalenyl)amino]-sulfanylidenemethyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[(2-hydroxynaphthalen-1-yl)carbamothioyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[(2-hydroxy-1-naphthyl)thiocarbamoyl]-3-nitro-4-piperidino-benzamide Formula: C23H22N4O4S MolecularWeight: 450.51018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=C(C=CC4=CC=CC=C43)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=C(C=CC4=CC=CC=C43)O)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O4S/c28-20-11-9-15-6-2-3-7-17(15)21(20)24-23(32)25-22(29)16-8-10-18(19(14-16)27(30)31)26-12-4-1-5-13-26/h2-3,6-11,14,28H,1,4-5,12-13H2,(H2,24,25,29,32)