4-[cyclopropyl-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl]amino]-N-(4-dimethylaminophenyl)-1-methyl-piperidine-4-carboxamide

Systemtic Name: 4-[cyclopropyl-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl]amino]-N-(4-dimethylaminophenyl)-1-methyl-piperidine-4-carboxamide Openeye Name: 4-[cyclopropyl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]-N-(4-dimethylaminophenyl)-1-methyl-piperidine-4-carboxamide CAS Name: 4-[cyclopropyl-[1-oxo-2-(4-phenyl-2-sulfanylidene-1-imidazolidinyl)ethyl]amino]-N-(4-dimethylaminophenyl)-1-methyl-4-piperidinecarboxamide IUPAC Name: 4-[cyclopropyl-[2-(4-phenyl-2-sulfanylideneimidazolidin-1-yl)acetyl]amino]-N-(4-dimethylaminophenyl)-1-methylpiperidine-4-carboxamide Traditional Name: 4-[cyclopropyl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]-N-(4-dimethylaminophenyl)-1-methyl-isonipecotamide Formula: C29H38N6O2S MolecularWeight: 534.71602

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C(=O)NC2=CC=C(C=C2)N(C)C)N(C3CC3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5

Isomeric SMILES

CN1CCC(CC1)(C(=O)NC2=CC=C(C=C2)N(C)C)N(C3CC3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5

InChI

InChI=1S/C29H38N6O2S/c1-32(2)23-11-9-22(10-12-23)30-27(37)29(15-17-33(3)18-16-29)35(24-13-14-24)26(36)20-34-19-25(31-28(34)38)21-7-5-4-6-8-21/h4-12,24-25H,13-20H2,1-3H3,(H,30,37)(H,31,38)