(3-prop-1-ynoxyphenyl) N-(2,4-dimethyl-3-oxidanylidene-pentyl)sulfanyl-N-methyl-carbamate

Systemtic Name: (3-prop-1-ynoxyphenyl) N-(2,4-dimethyl-3-oxidanylidene-pentyl)sulfanyl-N-methyl-carbamate Openeye Name: (3-prop-1-ynoxyphenyl) N-(2,4-dimethyl-3-oxo-pentyl)sulfanyl-N-methyl-carbamate CAS Name: N-[(2,4-dimethyl-3-oxopentyl)thio]-N-methylcarbamic acid (3-prop-1-ynoxyphenyl) ester IUPAC Name: (3-prop-1-ynoxyphenyl) N-(2,4-dimethyl-3-oxopentyl)sulfanyl-N-methylcarbamate Traditional Name: N-[(3-keto-2,4-dimethyl-pentyl)thio]-N-methyl-carbamic acid (3-prop-1-ynoxyphenyl) ester Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

CC#COC1=CC(=CC=C1)OC(=O)N(C)SCC(C)C(=O)C(C)C

Isomeric SMILES

CC#COC1=CC(=CC=C1)OC(=O)N(C)SCC(C)C(=O)C(C)C

InChI

InChI=1S/C18H23NO4S/c1-6-10-22-15-8-7-9-16(11-15)23-18(21)19(5)24-12-14(4)17(20)13(2)3/h7-9,11,13-14H,12H2,1-5H3