5-[(1-cyclopropyl-4-ethoxy-indol-6-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(1-cyclopropyl-4-ethoxy-indol-6-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(1-cyclopropyl-4-ethoxy-indol-6-yl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(1-cyclopropyl-4-ethoxy-6-indolyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(1-cyclopropyl-4-ethoxyindol-6-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(1-cyclopropyl-4-ethoxy-indol-6-yl)methyl]pyrimidin-4-yl]amine Formula: C18H21N5O MolecularWeight: 323.39224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC2=C1C=CN2C3CC3)CC4=CN=C(N=C4N)N

Isomeric SMILES

CCOC1=CC(=CC2=C1C=CN2C3CC3)CC4=CN=C(N=C4N)N

InChI

InChI=1S/C18H21N5O/c1-2-24-16-9-11(7-12-10-21-18(20)22-17(12)19)8-15-14(16)5-6-23(15)13-3-4-13/h5-6,8-10,13H,2-4,7H2,1H3,(H4,19,20,21,22)