5-(cyclopropyliminomethyl)-1,3-bis(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(cyclopropyliminomethyl)-1,3-bis(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(cyclopropyliminomethyl)-1,3-bis(o-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(cyclopropyliminomethyl)-1,3-bis(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(cyclopropyliminomethyl)-1,3-bis(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(cyclopropyliminomethyl)-1,3-bis(o-tolyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(C(=O)N(C2=S)C3=CC=CC=C3C)C=NC4CC4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(C(=O)N(C2=S)C3=CC=CC=C3C)C=NC4CC4

InChI

InChI=1S/C22H21N3O2S/c1-14-7-3-5-9-18(14)24-20(26)17(13-23-16-11-12-16)21(27)25(22(24)28)19-10-6-4-8-15(19)2/h3-10,13,16-17H,11-12H2,1-2H3