6-(1-adamantyl)-3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 6-(1-adamantyl)-3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-(1-adamantyl)-3-allyl-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-(1-adamantyl)-3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 6-(1-adamantyl)-3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-(1-adamantyl)-3-allyl-2-thioxo-1H-pyrimidin-4-one Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C=C(NC1=S)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CCN1C(=O)C=C(NC1=S)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H22N2OS/c1-2-3-19-15(20)7-14(18-16(19)21)17-8-11-4-12(9-17)6-13(5-11)10-17/h2,7,11-13H,1,3-6,8-10H2,(H,18,21)