4-(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)-N-phenyl-benzamide

Systemtic Name: 4-(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)-N-phenyl-benzamide Openeye Name: 4-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)-N-phenyl-benzamide CAS Name: 4-(4-amino-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)-N-phenylbenzamide IUPAC Name: 4-(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)-N-phenylbenzamide Traditional Name: 4-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)-N-phenyl-benzamide Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C21H18N4OS/c1-12-13(2)27-21-17(12)18(22)24-19(25-21)14-8-10-15(11-9-14)20(26)23-16-6-4-3-5-7-16/h3-11H,1-2H3,(H,23,26)(H2,22,24,25)