N-(4-chlorophenyl)-N-[2-(cycloheptylamino)-2-oxidanylidene-ethyl]-6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxamide

Systemtic Name: N-(4-chlorophenyl)-N-[2-(cycloheptylamino)-2-oxidanylidene-ethyl]-6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxamide Openeye Name: N-(4-chlorophenyl)-N-[2-(cycloheptylamino)-2-oxo-ethyl]-6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxamide CAS Name: N-(4-chlorophenyl)-N-[2-(cycloheptylamino)-2-oxoethyl]-6-methyl-2,3-dihydro-1,4-oxathiin-5-carboxamide IUPAC Name: N-(4-chlorophenyl)-N-[2-(cycloheptylamino)-2-oxoethyl]-6-methyl-2,3-dihydro-1,4-oxathiine-5-carboxamide Traditional Name: N-(4-chlorophenyl)-N-[2-(cycloheptylamino)-2-keto-ethyl]-6-methyl-2,3-dihydro-1,4-oxathiin-5-carboxamide Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SCCO1)C(=O)N(CC(=O)NC2CCCCCC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(SCCO1)C(=O)N(CC(=O)NC2CCCCCC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H27ClN2O3S/c1-15-20(28-13-12-27-15)21(26)24(18-10-8-16(22)9-11-18)14-19(25)23-17-6-4-2-3-5-7-17/h8-11,17H,2-7,12-14H2,1H3,(H,23,25)