1-[4-(2-azanylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-(4-methoxyphenoxy)ethanone

Systemtic Name: 1-[4-(2-azanylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-(4-methoxyphenoxy)ethanone Openeye Name: 1-[4-(2-aminothieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-(4-methoxyphenoxy)ethanone CAS Name: 1-[4-(2-amino-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-2-(4-methoxyphenoxy)ethanone IUPAC Name: 1-[4-(2-aminothieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-(4-methoxyphenoxy)ethanone Traditional Name: 1-[4-(2-aminothieno[2,3-d]pyrimidin-4-yl)piperazino]-2-(4-methoxyphenoxy)ethanone Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=C4C=CSC4=NC(=N3)N

Isomeric SMILES

COC1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=C4C=CSC4=NC(=N3)N

InChI

InChI=1S/C19H21N5O3S/c1-26-13-2-4-14(5-3-13)27-12-16(25)23-7-9-24(10-8-23)17-15-6-11-28-18(15)22-19(20)21-17/h2-6,11H,7-10,12H2,1H3,(H2,20,21,22)