N4-(1-pyridin-4-ylindol-5-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-2,4-diamine

Systemtic Name: N4-(1-pyridin-4-ylindol-5-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-2,4-diamine Openeye Name: N4-[1-(4-pyridyl)indol-5-yl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-2,4-diamine CAS Name: N4-(1-pyridin-4-yl-5-indolyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-2,4-diamine IUPAC Name: 4-N-(1-pyridin-4-ylindol-5-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-2,4-diamine Traditional Name: (2-amino-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl)-[1-(4-pyridyl)indol-5-yl]amine Formula: C22H22N6 MolecularWeight: 370.45028

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)N=C(N=C2NC3=CC4=C(C=C3)N(C=C4)C5=CC=NC=C5)N

Isomeric SMILES

C1CCC2=C(CC1)N=C(N=C2NC3=CC4=C(C=C3)N(C=C4)C5=CC=NC=C5)N

InChI

InChI=1S/C22H22N6/c23-22-26-19-5-3-1-2-4-18(19)21(27-22)25-16-6-7-20-15(14-16)10-13-28(20)17-8-11-24-12-9-17/h6-14H,1-5H2,(H3,23,25,26,27)