N-carbamothioyl-N-[4-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonylcyclohexyl]benzamide

Systemtic Name: N-carbamothioyl-N-[4-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonylcyclohexyl]benzamide Openeye Name: N-carbamothioyl-N-[4-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]cyclohexyl]benzamide CAS Name: N-carbamothioyl-N-[4-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-piperazinyl]-oxomethyl]cyclohexyl]benzamide IUPAC Name: N-carbamothioyl-N-[4-[4-(6-chloronaphthalen-2-yl)sulfonylpiperazine-1-carbonyl]cyclohexyl]benzamide Traditional Name: N-[4-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]cyclohexyl]-N-thiocarbamoyl-benzamide Formula: C29H31ClN4O4S2 MolecularWeight: 599.16384

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)N(C(=O)C5=CC=CC=C5)C(=S)N

Isomeric SMILES

C1CC(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)N(C(=O)C5=CC=CC=C5)C(=S)N

InChI

InChI=1S/C29H31ClN4O4S2/c30-24-10-6-23-19-26(13-9-22(23)18-24)40(37,38)33-16-14-32(15-17-33)27(35)21-7-11-25(12-8-21)34(29(31)39)28(36)20-4-2-1-3-5-20/h1-6,9-10,13,18-19,21,25H,7-8,11-12,14-17H2,(H2,31,39)