ethyl 5-(3-methylbutyl)-4,6-bis(oxidanylidene)-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-1-carboxylate

Systemtic Name: ethyl 5-(3-methylbutyl)-4,6-bis(oxidanylidene)-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-1-carboxylate Openeye Name: ethyl 5-allyl-5-isopentyl-4,6-dioxo-2-thioxo-hexahydropyrimidine-1-carboxylate CAS Name: 5-(3-methylbutyl)-4,6-dioxo-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-1-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-methylbutyl)-4,6-dioxo-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-1-carboxylate Traditional Name: 5-allyl-5-isoamyl-4,6-diketo-2-thioxo-hexahydropyrimidine-1-carboxylic acid ethyl ester Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=O)C(C(=O)NC1=S)(CCC(C)C)CC=C

Isomeric SMILES

CCOC(=O)N1C(=O)C(C(=O)NC1=S)(CCC(C)C)CC=C

InChI

InChI=1S/C15H22N2O4S/c1-5-8-15(9-7-10(3)4)11(18)16-13(22)17(12(15)19)14(20)21-6-2/h5,10H,1,6-9H2,2-4H3,(H,16,18,22)