ethyl 3-[[4-(4-azanyl-6-methyl-thieno[2,3-d]pyrimidin-5-yl)phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 3-[[4-(4-azanyl-6-methyl-thieno[2,3-d]pyrimidin-5-yl)phenyl]carbamoylamino]benzoate Openeye Name: ethyl 3-[[4-(4-amino-6-methyl-thieno[2,3-d]pyrimidin-5-yl)phenyl]carbamoylamino]benzoate CAS Name: 3-[[[4-(4-amino-6-methyl-5-thieno[2,3-d]pyrimidinyl)anilino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-amino-6-methylthieno[2,3-d]pyrimidin-5-yl)phenyl]carbamoylamino]benzoate Traditional Name: 3-[[4-(4-amino-6-methyl-thieno[2,3-d]pyrimidin-5-yl)phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C23H21N5O3S MolecularWeight: 447.50954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=C(SC4=NC=NC(=C34)N)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=C(SC4=NC=NC(=C34)N)C

InChI

InChI=1S/C23H21N5O3S/c1-3-31-22(29)15-5-4-6-17(11-15)28-23(30)27-16-9-7-14(8-10-16)18-13(2)32-21-19(18)20(24)25-12-26-21/h4-12H,3H2,1-2H3,(H2,24,25,26)(H2,27,28,30)