N-(1-adamantylmethyl)-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-(1-adamantylmethyl)-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-(1-adamantylmethyl)-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-(1-adamantylmethyl)-3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-(1-adamantylmethyl)-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-(1-adamantylmethyl)-3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]propionamide Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H29N3O2S/c1-12-16(18(25)23-19(22-12)26-2)3-4-17(24)21-11-20-8-13-5-14(9-20)7-15(6-13)10-20/h13-15H,3-11H2,1-2H3,(H,21,24)(H,22,23,25)