N-[[2,3-bis(chloranyl)phenyl]carbamothioyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[[2,3-bis(chloranyl)phenyl]carbamothioyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[(2,3-dichlorophenyl)carbamothioyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[(2,3-dichloroanilino)-sulfanylidenemethyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[(2,3-dichlorophenyl)carbamothioyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[(2,3-dichlorophenyl)thiocarbamoyl]-3-nitro-4-piperidino-benzamide Formula: C19H18Cl2N4O3S MolecularWeight: 453.34222

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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(=CC=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C19H18Cl2N4O3S/c20-13-5-4-6-14(17(13)21)22-19(29)23-18(26)12-7-8-15(16(11-12)25(27)28)24-9-2-1-3-10-24/h4-8,11H,1-3,9-10H2,(H2,22,23,26,29)