propan-2-yl 5-methyl-2-[(3-methylpiperazin-1-yl)methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: propan-2-yl 5-methyl-2-[(3-methylpiperazin-1-yl)methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 5-methyl-2-[(3-methylpiperazin-1-yl)methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[(3-methyl-1-piperazinyl)methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-methyl-2-[(3-methylpiperazin-1-yl)methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[(3-methylpiperazino)methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C17H24N4O3S MolecularWeight: 364.46246

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=NC3=C(C(=C(S3)C(=O)OC(C)C)C)C(=O)N2

Isomeric SMILES

CC1CN(CCN1)CC2=NC3=C(C(=C(S3)C(=O)OC(C)C)C)C(=O)N2

InChI

InChI=1S/C17H24N4O3S/c1-9(2)24-17(23)14-11(4)13-15(22)19-12(20-16(13)25-14)8-21-6-5-18-10(3)7-21/h9-10,18H,5-8H2,1-4H3,(H,19,20,22)