2-cyclopropyl-4-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-6-methyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-cyclopropyl-4-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-6-methyl-pyrimidine-5-carbonitrile Openeye Name: 2-cyclopropyl-4-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-6-methyl-pyrimidine-5-carbonitrile CAS Name: 2-cyclopropyl-4-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-6-methyl-5-pyrimidinecarbonitrile IUPAC Name: 2-cyclopropyl-4-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-6-methylpyrimidine-5-carbonitrile Traditional Name: 2-cyclopropyl-4-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]-6-methyl-pyrimidine-5-carbonitrile Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC(=NC(=C3C#N)C)C4CC4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC(=NC(=C3C#N)C)C4CC4)C

InChI

InChI=1S/C21H19N3O2S/c1-11-6-16-15(8-19(25)26-18(16)7-12(11)2)10-27-21-17(9-22)13(3)23-20(24-21)14-4-5-14/h6-8,14H,4-5,10H2,1-3H3