(4S,5S)-N-(4-ethoxyphenyl)-4-(4-hydroxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxamide

Systemtic Name: (4S,5S)-N-(4-ethoxyphenyl)-4-(4-hydroxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxamide Openeye Name: (4S,5S)-N-(4-ethoxyphenyl)-4-(4-hydroxyphenyl)-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxamide CAS Name: (4S,5S)-N-(4-ethoxyphenyl)-4-(4-hydroxyphenyl)-6-methylene-2-sulfanylidene-1,3-diazinane-5-carboxamide IUPAC Name: (4S,5S)-N-(4-ethoxyphenyl)-4-(4-hydroxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxamide Traditional Name: (4S,5S)-4-(4-hydroxyphenyl)-6-methylene-N-p-phenetyl-2-thioxo-hexahydropyrimidine-5-carboxamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2C(NC(=S)NC2=C)C3=CC=C(C=C3)O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)[C@H]2[C@H](NC(=S)NC2=C)C3=CC=C(C=C3)O

InChI

InChI=1S/C20H21N3O3S/c1-3-26-16-10-6-14(7-11-16)22-19(25)17-12(2)21-20(27)23-18(17)13-4-8-15(24)9-5-13/h4-11,17-18,24H,2-3H2,1H3,(H,22,25)(H2,21,23,27)/t17-,18-/m1/s1