2-(4-azanyl-5-azanylidene-1-ethanoyl-thieno[3,4-d]pyridazin-3-yl)-5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-(4-azanyl-5-azanylidene-1-ethanoyl-thieno[3,4-d]pyridazin-3-yl)-5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-(1-acetyl-4-amino-5-imino-thieno[3,4-d]pyridazin-3-yl)-5,5-dimethyl-7-oxo-4,6-dihydrobenzothiophene-3-carbonitrile CAS Name: 2-(1-acetyl-4-amino-5-imino-3-thieno[3,4-d]pyridazinyl)-5,5-dimethyl-7-oxo-4,6-dihydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-(1-acetyl-4-amino-5-iminothieno[3,4-d]pyridazin-3-yl)-5,5-dimethyl-7-oxo-4,6-dihydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-(1-acetyl-4-amino-5-imino-thieno[3,4-d]pyridazin-3-yl)-7-keto-5,5-dimethyl-4,6-dihydrobenzothiophene-3-carbonitrile Formula: C19H17N5O2S2 MolecularWeight: 411.50058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=C2C1=CSC2=N)N)C3=C(C4=C(S3)C(=O)CC(C4)(C)C)C#N

Isomeric SMILES

CC(=O)C1=NN(C(=C2C1=CSC2=N)N)C3=C(C4=C(S3)C(=O)CC(C4)(C)C)C#N

InChI

InChI=1S/C19H17N5O2S2/c1-8(25)14-11-7-27-17(22)13(11)16(21)24(23-14)18-10(6-20)9-4-19(2,3)5-12(26)15(9)28-18/h7,22H,4-5,21H2,1-3H3