2-[(6-methyl-4-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-phenoxyphenyl)ethanamide

Systemtic Name: 2-[(6-methyl-4-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-phenoxyphenyl)ethanamide Openeye Name: 2-[(5-allyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide CAS Name: 2-[(6-methyl-4-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)thio]-N-(4-phenoxyphenyl)acetamide IUPAC Name: 2-[(6-methyl-4-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide Traditional Name: 2-[(5-allyl-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-N-(4-phenoxyphenyl)acetamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)CC=C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)CC=C

InChI

InChI=1S/C22H21N3O3S/c1-3-7-19-15(2)23-22(25-21(19)27)29-14-20(26)24-16-10-12-18(13-11-16)28-17-8-5-4-6-9-17/h3-6,8-13H,1,7,14H2,2H3,(H,24,26)(H,23,25,27)