N-[2-[3-[(3,5-dimethylphenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[3-[(3,5-dimethylphenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-[3-[(3,5-dimethylphenyl)methyl]-2-oxo-hexahydropyrimidin-1-yl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-[3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-[3-(3,5-dimethylbenzyl)-2-keto-hexahydropyrimidin-1-yl]phenyl]thiophene-2-carboxamide Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2CCCN(C2=O)C3=CC=CC=C3NC(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2CCCN(C2=O)C3=CC=CC=C3NC(=O)C4=CC=CS4)C

InChI

InChI=1S/C24H25N3O2S/c1-17-13-18(2)15-19(14-17)16-26-10-6-11-27(24(26)29)21-8-4-3-7-20(21)25-23(28)22-9-5-12-30-22/h3-5,7-9,12-15H,6,10-11,16H2,1-2H3,(H,25,28)