O-ethyl [2-[cyclohex-2-en-1-ylmethyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate

Systemtic Name: O-ethyl [2-[cyclohex-2-en-1-ylmethyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate Openeye Name: O-ethyl [2-[cyclohex-2-en-1-ylmethyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxo-ethyl]sulfanylmethanethioate CAS Name: [[2-[1-cyclohex-2-enylmethyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]thio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl [2-[cyclohex-2-en-1-ylmethyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]sulfanylmethanethioate Traditional Name: [[2-[cyclohex-2-en-1-ylmethyl-[2-(1H-indol-3-yl)ethyl]amino]-2-keto-ethyl]thio]methanethioic acid O-ethyl ester Formula: C22H28N2O2S2 MolecularWeight: 416.59992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SCC(=O)N(CCC1=CNC2=CC=CC=C21)CC3CCCC=C3

Isomeric SMILES

CCOC(=S)SCC(=O)N(CCC1=CNC2=CC=CC=C21)CC3CCCC=C3

InChI

InChI=1S/C22H28N2O2S2/c1-2-26-22(27)28-16-21(25)24(15-17-8-4-3-5-9-17)13-12-18-14-23-20-11-7-6-10-19(18)20/h4,6-8,10-11,14,17,23H,2-3,5,9,12-13,15-16H2,1H3