1-[4-(4-azanyl-7-pyrimidin-5-yl-thieno[3,2-c]pyridin-3-yl)phenyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[4-(4-azanyl-7-pyrimidin-5-yl-thieno[3,2-c]pyridin-3-yl)phenyl]-3-(3-methylphenyl)urea Openeye Name: 1-[4-(4-amino-7-pyrimidin-5-yl-thieno[3,2-c]pyridin-3-yl)phenyl]-3-(m-tolyl)urea CAS Name: 1-[4-[4-amino-7-(5-pyrimidinyl)-3-thieno[3,2-c]pyridinyl]phenyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[4-(4-amino-7-pyrimidin-5-ylthieno[3,2-c]pyridin-3-yl)phenyl]-3-(3-methylphenyl)urea Traditional Name: 1-[4-[4-amino-7-(5-pyrimidyl)thieno[3,2-c]pyridin-3-yl]phenyl]-3-(m-tolyl)urea Formula: C25H20N6OS MolecularWeight: 452.5309

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=CSC4=C3C(=NC=C4C5=CN=CN=C5)N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=CSC4=C3C(=NC=C4C5=CN=CN=C5)N

InChI

InChI=1S/C25H20N6OS/c1-15-3-2-4-19(9-15)31-25(32)30-18-7-5-16(6-8-18)21-13-33-23-20(12-29-24(26)22(21)23)17-10-27-14-28-11-17/h2-14H,1H3,(H2,26,29)(H2,30,31,32)