N-(naphthalen-1-ylcarbamothioyl)-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-(naphthalen-1-ylcarbamothioyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(1-naphthylcarbamothioyl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[(1-naphthalenylamino)-sulfanylidenemethyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(naphthalen-1-ylcarbamothioyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(1-naphthylthiocarbamoyl)-3-nitro-4-piperidino-benzamide Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N4O3S/c28-22(25-23(31)24-19-10-6-8-16-7-2-3-9-18(16)19)17-11-12-20(21(15-17)27(29)30)26-13-4-1-5-14-26/h2-3,6-12,15H,1,4-5,13-14H2,(H2,24,25,28,31)