2-methylpropyl 5-methyl-2-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-methylpropyl 5-methyl-2-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]-1,3-thiazole-4-carboxylate Openeye Name: isobutyl 5-methyl-2-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]thiazole-4-carboxylate CAS Name: 5-methyl-2-[[1-oxo-2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]ethyl]amino]-4-thiazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 5-methyl-2-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]-1,3-thiazole-4-carboxylate Traditional Name: 5-methyl-2-[[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]thiazole-4-carboxylic acid isobutyl ester Formula: C23H22N4O3S3 MolecularWeight: 498.64078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)CSC2=NC=NC3=C2C(=CS3)C4=CC=CC=C4)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)CSC2=NC=NC3=C2C(=CS3)C4=CC=CC=C4)C(=O)OCC(C)C

InChI

InChI=1S/C23H22N4O3S3/c1-13(2)9-30-22(29)19-14(3)33-23(27-19)26-17(28)11-32-21-18-16(15-7-5-4-6-8-15)10-31-20(18)24-12-25-21/h4-8,10,12-13H,9,11H2,1-3H3,(H,26,27,28)