[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]acetic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]acetic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)COC(=O)CSC2=NC=NC3=C2C(=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CC1NC(=O)COC(=O)CSC2=NC=NC3=C2C(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C19H17N3O3S2/c23-15(22-13-6-7-13)8-25-16(24)10-27-19-17-14(12-4-2-1-3-5-12)9-26-18(17)20-11-21-19/h1-5,9,11,13H,6-8,10H2,(H,22,23)