1-[4-(4-azanyl-6-ethyl-thieno[2,3-d]pyrimidin-5-yl)phenyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[4-(4-azanyl-6-ethyl-thieno[2,3-d]pyrimidin-5-yl)phenyl]-3-(3-methylphenyl)urea Openeye Name: 1-[4-(4-amino-6-ethyl-thieno[2,3-d]pyrimidin-5-yl)phenyl]-3-(m-tolyl)urea CAS Name: 1-[4-(4-amino-6-ethyl-5-thieno[2,3-d]pyrimidinyl)phenyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[4-(4-amino-6-ethylthieno[2,3-d]pyrimidin-5-yl)phenyl]-3-(3-methylphenyl)urea Traditional Name: 1-[4-(4-amino-6-ethyl-thieno[2,3-d]pyrimidin-5-yl)phenyl]-3-(m-tolyl)urea Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N=CN=C2S1)N)C3=CC=C(C=C3)NC(=O)NC4=CC=CC(=C4)C

Isomeric SMILES

CCC1=C(C2=C(N=CN=C2S1)N)C3=CC=C(C=C3)NC(=O)NC4=CC=CC(=C4)C

InChI

InChI=1S/C22H21N5OS/c1-3-17-18(19-20(23)24-12-25-21(19)29-17)14-7-9-15(10-8-14)26-22(28)27-16-6-4-5-13(2)11-16/h4-12H,3H2,1-2H3,(H2,23,24,25)(H2,26,27,28)