1-(4-cyclohexylpiperazin-1-yl)-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-cyclohexylpiperazin-1-yl)-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-cyclohexylpiperazin-1-yl)-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanyl-ethanone CAS Name: 1-(4-cyclohexyl-1-piperazinyl)-2-[[3-(1-pyrrolidinyl)-2-quinoxalinyl]thio]ethanone IUPAC Name: 1-(4-cyclohexylpiperazin-1-yl)-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanylethanone Traditional Name: 1-(4-cyclohexylpiperazino)-2-[(3-pyrrolidinoquinoxalin-2-yl)thio]ethanone Formula: C24H33N5OS MolecularWeight: 439.61672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4N=C3N5CCCC5

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4N=C3N5CCCC5

InChI

InChI=1S/C24H33N5OS/c30-22(28-16-14-27(15-17-28)19-8-2-1-3-9-19)18-31-24-23(29-12-6-7-13-29)25-20-10-4-5-11-21(20)26-24/h4-5,10-11,19H,1-3,6-9,12-18H2