(5R,6S)-N-(3-chloranyl-2-methyl-phenyl)-4-methylidene-6-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide

Systemtic Name: (5R,6S)-N-(3-chloranyl-2-methyl-phenyl)-4-methylidene-6-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide Openeye Name: (5R,6S)-N-(3-chloro-2-methyl-phenyl)-4-methylene-6-(o-tolyl)-2-thioxo-hexahydropyrimidine-5-carboxamide CAS Name: (5R,6S)-N-(3-chloro-2-methylphenyl)-4-methylene-6-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide IUPAC Name: (5R,6S)-N-(3-chloro-2-methylphenyl)-4-methylidene-6-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide Traditional Name: (5R,6S)-N-(3-chloro-2-methyl-phenyl)-4-methylene-6-(o-tolyl)-2-thioxo-hexahydropyrimidine-5-carboxamide Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(C(=C)NC(=S)N2)C(=O)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC=CC=C1[C@@H]2[C@H](C(=C)NC(=S)N2)C(=O)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C20H20ClN3OS/c1-11-7-4-5-8-14(11)18-17(13(3)22-20(26)24-18)19(25)23-16-10-6-9-15(21)12(16)2/h4-10,17-18H,3H2,1-2H3,(H,23,25)(H2,22,24,26)/t17-,18+/m0/s1