methyl 2,4-dimethyl-5-[2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[(6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)thio]acetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=NC3=C2C(=C(S3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=NC3=C2C(=C(S3)C)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O3S2/c1-12-17(23(28)29-4)13(2)26-20(12)16(27)10-30-21-19-18(15-8-6-5-7-9-15)14(3)31-22(19)25-11-24-21/h5-9,11,26H,10H2,1-4H3