2-cyclopentylsulfanyl-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one

Systemtic Name: 2-cyclopentylsulfanyl-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one Openeye Name: 5-allyl-2-cyclopentylsulfanyl-6-phenyl-hexahydropyrimidin-4-one CAS Name: 2-(cyclopentylthio)-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one IUPAC Name: 2-cyclopentylsulfanyl-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one Traditional Name: 5-allyl-2-(cyclopentylthio)-6-phenyl-hexahydropyrimidin-4-one Formula: C18H24N2OS MolecularWeight: 316.46096

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1C(NC(NC1=O)SC2CCCC2)C3=CC=CC=C3

Isomeric SMILES

C=CCC1C(NC(NC1=O)SC2CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C18H24N2OS/c1-2-8-15-16(13-9-4-3-5-10-13)19-18(20-17(15)21)22-14-11-6-7-12-14/h2-5,9-10,14-16,18-19H,1,6-8,11-12H2,(H,20,21)