N-[2-(3,4-dichlorophenyl)-4-[4-(3-methyl-2-sulfanylidene-1,3-diazinan-1-yl)piperidin-1-yl]butyl]-N-methyl-benzamide

Systemtic Name: N-[2-(3,4-dichlorophenyl)-4-[4-(3-methyl-2-sulfanylidene-1,3-diazinan-1-yl)piperidin-1-yl]butyl]-N-methyl-benzamide Openeye Name: N-[2-(3,4-dichlorophenyl)-4-[4-(3-methyl-2-thioxo-hexahydropyrimidin-1-yl)-1-piperidyl]butyl]-N-methyl-benzamide CAS Name: N-[2-(3,4-dichlorophenyl)-4-[4-(3-methyl-2-sulfanylidene-1,3-diazinan-1-yl)-1-piperidinyl]butyl]-N-methylbenzamide IUPAC Name: N-[2-(3,4-dichlorophenyl)-4-[4-(3-methyl-2-sulfanylidene-1,3-diazinan-1-yl)piperidin-1-yl]butyl]-N-methylbenzamide Traditional Name: N-[2-(3,4-dichlorophenyl)-4-[4-(3-methyl-2-thioxo-hexahydropyrimidin-1-yl)piperidino]butyl]-N-methyl-benzamide Formula: C28H36Cl2N4OS MolecularWeight: 547.58264

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(C1=S)C2CCN(CC2)CCC(CN(C)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CN1CCCN(C1=S)C2CCN(CC2)CCC(CN(C)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C28H36Cl2N4OS/c1-31-14-6-15-34(28(31)36)24-12-17-33(18-13-24)16-11-23(22-9-10-25(29)26(30)19-22)20-32(2)27(35)21-7-4-3-5-8-21/h3-5,7-10,19,23-24H,6,11-18,20H2,1-2H3