N-[4-[3-(4-cyclohexylpiperazin-1-yl)propylcarbamoyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[4-[3-(4-cyclohexylpiperazin-1-yl)propylcarbamoyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[4-[3-(4-cyclohexylpiperazin-1-yl)propylcarbamoyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[4-[[3-(4-cyclohexyl-1-piperazinyl)propylamino]-oxomethyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[4-[3-(4-cyclohexylpiperazin-1-yl)propylcarbamoyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[4-[3-(4-cyclohexylpiperazino)propylcarbamoyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)CCCNC(=O)C3=CC=C(C=C3)NC(=O)C4=CSCCO4

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)CCCNC(=O)C3=CC=C(C=C3)NC(=O)C4=CSCCO4

InChI

InChI=1S/C25H36N4O3S/c30-24(20-7-9-21(10-8-20)27-25(31)23-19-33-18-17-32-23)26-11-4-12-28-13-15-29(16-14-28)22-5-2-1-3-6-22/h7-10,19,22H,1-6,11-18H2,(H,26,30)(H,27,31)