5,6-dimethyl-3-(5-methyl-4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-pyridazine-4-carbonitrile

Systemtic Name: 5,6-dimethyl-3-(5-methyl-4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-pyridazine-4-carbonitrile Openeye Name: 3-(3-allyl-5-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-5,6-dimethyl-pyridazine-4-carbonitrile CAS Name: 5,6-dimethyl-3-[(5-methyl-4-oxo-6-phenyl-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-4-pyridazinecarbonitrile IUPAC Name: 5,6-dimethyl-3-(5-methyl-4-oxo-6-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylpyridazine-4-carbonitrile Traditional Name: 3-[(3-allyl-4-keto-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C23H19N5OS2 MolecularWeight: 445.55986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN=C1C)SC2=NC3=C(C(=C(S3)C4=CC=CC=C4)C)C(=O)N2CC=C)C#N

Isomeric SMILES

CC1=C(C(=NN=C1C)SC2=NC3=C(C(=C(S3)C4=CC=CC=C4)C)C(=O)N2CC=C)C#N

InChI

InChI=1S/C23H19N5OS2/c1-5-11-28-22(29)18-14(3)19(16-9-7-6-8-10-16)30-21(18)25-23(28)31-20-17(12-24)13(2)15(4)26-27-20/h5-10H,1,11H2,2-4H3