1-[4-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]butyl]-3-methyl-urea

Systemtic Name: 1-[4-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]butyl]-3-methyl-urea Openeye Name: 1-[4-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]butyl]-3-methyl-urea CAS Name: 1-[4-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]butyl]-3-methylurea IUPAC Name: 1-[4-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]butyl]-3-methylurea Traditional Name: 1-[4-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]butyl]-3-methyl-urea Formula: C20H26N6O MolecularWeight: 366.46004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C(=NC(=N2)C3=CC=CC=C3)NCCCCNC(=O)NC)C

Isomeric SMILES

CC1=C(NC2=C1C(=NC(=N2)C3=CC=CC=C3)NCCCCNC(=O)NC)C

InChI

InChI=1S/C20H26N6O/c1-13-14(2)24-19-16(13)18(22-11-7-8-12-23-20(27)21-3)25-17(26-19)15-9-5-4-6-10-15/h4-6,9-10H,7-8,11-12H2,1-3H3,(H2,21,23,27)(H2,22,24,25,26)