2-[2-[(2,6-dimethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]ethanoylamino]ethanoate

Systemtic Name: 2-[2-[(2,6-dimethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]ethanoylamino]ethanoate Openeye Name: 2-[[2-[(2,6-dimethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]acetyl]amino]acetate CAS Name: 2-[[2-[(2,6-dimethyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]-1-oxoethyl]amino]acetate IUPAC Name: 2-[[2-[(2,6-dimethyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetyl]amino]acetate Traditional Name: 2-[[2-[(2,6-dimethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]acetyl]amino]acetate Formula: C18H17N4O3S- MolecularWeight: 369.41758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=C(N=C2S1)C)NCC(=O)NCC(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(N=C(N=C2S1)C)NCC(=O)NCC(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O3S/c1-10-15(12-6-4-3-5-7-12)16-17(21-11(2)22-18(16)26-10)20-8-13(23)19-9-14(24)25/h3-7H,8-9H2,1-2H3,(H,19,23)(H,24,25)(H,20,21,22)/p-1