ethyl 5-methyl-3-[(E)-(1-methylindol-3-yl)methylideneamino]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-3-[(E)-(1-methylindol-3-yl)methylideneamino]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-3-[(E)-(1-methylindol-3-yl)methyleneamino]-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-[(E)-(1-methyl-3-indolyl)methylideneamino]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-3-[(E)-(1-methylindol-3-yl)methylideneamino]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-[(E)-(1-methylindol-3-yl)methyleneamino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)N=CC3=CN(C4=CC=CC=C43)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)/N=C/C3=CN(C4=CC=CC=C43)C)C

InChI

InChI=1S/C20H18N4O3S/c1-4-27-20(26)17-12(2)16-18(28-17)21-11-24(19(16)25)22-9-13-10-23(3)15-8-6-5-7-14(13)15/h5-11H,4H2,1-3H3/b22-9+