N-[5-[3-(4-cyclohexylpiperazin-1-yl)propylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[5-[3-(4-cyclohexylpiperazin-1-yl)propylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[5-[3-(4-cyclohexylpiperazin-1-yl)propylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[5-[[3-(4-cyclohexyl-1-piperazinyl)propylamino]-oxomethyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[5-[3-(4-cyclohexylpiperazin-1-yl)propylcarbamoyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[5-[3-(4-cyclohexylpiperazino)propylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C26H38N4O3S MolecularWeight: 486.66992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCCN2CCN(CC2)C3CCCCC3)NC(=O)C4=CSCCO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCCN2CCN(CC2)C3CCCCC3)NC(=O)C4=CSCCO4

InChI

InChI=1S/C26H38N4O3S/c1-20-8-9-21(18-23(20)28-26(32)24-19-34-17-16-33-24)25(31)27-10-5-11-29-12-14-30(15-13-29)22-6-3-2-4-7-22/h8-9,18-19,22H,2-7,10-17H2,1H3,(H,27,31)(H,28,32)