O-ethyl [2-[cyclohex-2-en-1-yl-[(4-methoxyphenyl)methyl]amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylmethanethioate

Systemtic Name: O-ethyl [2-[cyclohex-2-en-1-yl-[(4-methoxyphenyl)methyl]amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylmethanethioate Openeye Name: O-ethyl [2-[cyclohex-2-en-1-yl-[(4-methoxyphenyl)methyl]amino]-2-oxo-1-phenyl-ethyl]sulfanylmethanethioate CAS Name: [[2-[1-cyclohex-2-enyl-[(4-methoxyphenyl)methyl]amino]-2-oxo-1-phenylethyl]thio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl [2-[cyclohex-2-en-1-yl-[(4-methoxyphenyl)methyl]amino]-2-oxo-1-phenylethyl]sulfanylmethanethioate Traditional Name: [[2-[cyclohex-2-en-1-yl(p-anisyl)amino]-2-keto-1-phenyl-ethyl]thio]methanethioic acid O-ethyl ester Formula: C25H29NO3S2 MolecularWeight: 455.63266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(C1=CC=CC=C1)C(=O)N(CC2=CC=C(C=C2)OC)C3CCCC=C3

Isomeric SMILES

CCOC(=S)SC(C1=CC=CC=C1)C(=O)N(CC2=CC=C(C=C2)OC)C3CCCC=C3

InChI

InChI=1S/C25H29NO3S2/c1-3-29-25(30)31-23(20-10-6-4-7-11-20)24(27)26(21-12-8-5-9-13-21)18-19-14-16-22(28-2)17-15-19/h4,6-8,10-12,14-17,21,23H,3,5,9,13,18H2,1-2H3