5-methyl-6-oxidanylidene-2-phenyl-1-prop-2-ynyl-pyrimidine-4-carbothialdehyde

Systemtic Name: 5-methyl-6-oxidanylidene-2-phenyl-1-prop-2-ynyl-pyrimidine-4-carbothialdehyde Openeye Name: 5-methyl-6-oxo-2-phenyl-1-prop-2-ynyl-pyrimidine-4-carbothialdehyde CAS Name: 5-methyl-6-oxo-2-phenyl-1-prop-2-ynyl-4-pyrimidinecarbothioaldehyde IUPAC Name: 5-methyl-6-oxo-2-phenyl-1-prop-2-ynylpyrimidine-4-carbothialdehyde Traditional Name: 6-keto-5-methyl-2-phenyl-1-propargyl-pyrimidine-4-carbothialdehyde Formula: C15H12N2OS MolecularWeight: 268.33358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N(C1=O)CC#C)C2=CC=CC=C2)C=S

Isomeric SMILES

CC1=C(N=C(N(C1=O)CC#C)C2=CC=CC=C2)C=S

InChI

InChI=1S/C15H12N2OS/c1-3-9-17-14(12-7-5-4-6-8-12)16-13(10-19)11(2)15(17)18/h1,4-8,10H,9H2,2H3