(4R,5S)-N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxamide

Systemtic Name: (4R,5S)-N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxamide Openeye Name: (4R,5S)-N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxamide CAS Name: (4R,5S)-N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylene-2-sulfanylidene-1,3-diazinane-5-carboxamide IUPAC Name: (4R,5S)-N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxamide Traditional Name: (4R,5S)-N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxamide Formula: C20H18ClN3O3S MolecularWeight: 415.89322

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(NC(=S)N1)C2=CC3=C(C=C2)OCCO3)C(=O)NC4=CC=CC=C4Cl

Isomeric SMILES

C=C1[C@H]([C@@H](NC(=S)N1)C2=CC3=C(C=C2)OCCO3)C(=O)NC4=CC=CC=C4Cl

InChI

InChI=1S/C20H18ClN3O3S/c1-11-17(19(25)23-14-5-3-2-4-13(14)21)18(24-20(28)22-11)12-6-7-15-16(10-12)27-9-8-26-15/h2-7,10,17-18H,1,8-9H2,(H,23,25)(H2,22,24,28)/t17-,18+/m1/s1