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

Systemtic Name: (4S,5R)-4-(2-cyclopentyloxyphenyl)-6-methylidene-N-(3-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide Openeye Name: (4S,5R)-4-[2-(cyclopentoxy)phenyl]-6-methylene-N-(m-tolyl)-2-thioxo-hexahydropyrimidine-5-carboxamide CAS Name: (4S,5R)-4-(2-cyclopentyloxyphenyl)-6-methylene-N-(3-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide IUPAC Name: (4S,5R)-4-(2-cyclopentyloxyphenyl)-6-methylidene-N-(3-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide Traditional Name: (4S,5R)-4-[2-(cyclopentoxy)phenyl]-6-methylene-N-(m-tolyl)-2-thioxo-hexahydropyrimidine-5-carboxamide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2C(NC(=S)NC2=C)C3=CC=CC=C3OC4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)[C@@H]2[C@H](NC(=S)NC2=C)C3=CC=CC=C3OC4CCCC4

InChI

InChI=1S/C24H27N3O2S/c1-15-8-7-9-17(14-15)26-23(28)21-16(2)25-24(30)27-22(21)19-12-5-6-13-20(19)29-18-10-3-4-11-18/h5-9,12-14,18,21-22H,2-4,10-11H2,1H3,(H,26,28)(H2,25,27,30)/t21-,22+/m0/s1