methyl 2-[3-oxidanylidene-1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[3-oxidanylidene-1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-2-yl]ethanoate Openeye Name: methyl 2-[3-oxo-1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-(6-phenyl-4-thieno[2,3-d]pyrimidinyl)-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-oxo-1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-2-yl]acetic acid methyl ester Formula: C19H18N4O3S MolecularWeight: 382.43622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1C2=C3C=C(SC3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CC1C(=O)NCCN1C2=C3C=C(SC3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C19H18N4O3S/c1-26-16(24)10-14-18(25)20-7-8-23(14)17-13-9-15(12-5-3-2-4-6-12)27-19(13)22-11-21-17/h2-6,9,11,14H,7-8,10H2,1H3,(H,20,25)