methyl 2-[5,6-dimethyl-4-(quinolin-3-ylamino)thieno[2,3-d]pyrimidin-2-yl]ethanoate

Systemtic Name: methyl 2-[5,6-dimethyl-4-(quinolin-3-ylamino)thieno[2,3-d]pyrimidin-2-yl]ethanoate Openeye Name: methyl 2-[5,6-dimethyl-4-(3-quinolylamino)thieno[2,3-d]pyrimidin-2-yl]acetate CAS Name: 2-[5,6-dimethyl-4-(3-quinolinylamino)-2-thieno[2,3-d]pyrimidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[5,6-dimethyl-4-(quinolin-3-ylamino)thieno[2,3-d]pyrimidin-2-yl]acetate Traditional Name: 2-[5,6-dimethyl-4-(3-quinolylamino)thieno[2,3-d]pyrimidin-2-yl]acetic acid methyl ester Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NC3=CC4=CC=CC=C4N=C3)CC(=O)OC)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NC3=CC4=CC=CC=C4N=C3)CC(=O)OC)C

InChI

InChI=1S/C20H18N4O2S/c1-11-12(2)27-20-18(11)19(23-16(24-20)9-17(25)26-3)22-14-8-13-6-4-5-7-15(13)21-10-14/h4-8,10H,9H2,1-3H3,(H,22,23,24)