methyl N-[1,3-benzodioxol-5-ylcarbonyl(2-cyclohex-2-en-1-ylethyl)amino]-N-phenyl-carbamodithioate

Systemtic Name: methyl N-[1,3-benzodioxol-5-ylcarbonyl(2-cyclohex-2-en-1-ylethyl)amino]-N-phenyl-carbamodithioate Openeye Name: methyl N-[1,3-benzodioxole-5-carbonyl(2-cyclohex-2-en-1-ylethyl)amino]-N-phenyl-carbamodithioate CAS Name: N-[[1,3-benzodioxol-5-yl(oxo)methyl]-[2-(1-cyclohex-2-enyl)ethyl]amino]-N-phenylcarbamodithioic acid methyl ester IUPAC Name: methyl N-[1,3-benzodioxole-5-carbonyl(2-cyclohex-2-en-1-ylethyl)amino]-N-phenylcarbamodithioate Traditional Name: N-[2-cyclohex-2-en-1-ylethyl(piperonyloyl)amino]-N-phenyl-carbamodithioic acid methyl ester Formula: C24H26N2O3S2 MolecularWeight: 454.60484

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)N(C1=CC=CC=C1)N(CCC2CCCC=C2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CSC(=S)N(C1=CC=CC=C1)N(CCC2CCCC=C2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H26N2O3S2/c1-31-24(30)26(20-10-6-3-7-11-20)25(15-14-18-8-4-2-5-9-18)23(27)19-12-13-21-22(16-19)29-17-28-21/h3-4,6-8,10-13,16,18H,2,5,9,14-15,17H2,1H3