2-methyl-N-(2-pyrrolidin-1-ylethyl)-9-(2,4,6-trimethylphenyl)pyrimido[4,5-b]indol-4-amine

Systemtic Name: 2-methyl-N-(2-pyrrolidin-1-ylethyl)-9-(2,4,6-trimethylphenyl)pyrimido[4,5-b]indol-4-amine Openeye Name: 2-methyl-N-(2-pyrrolidin-1-ylethyl)-9-(2,4,6-trimethylphenyl)pyrimido[4,5-b]indol-4-amine CAS Name: 2-methyl-N-[2-(1-pyrrolidinyl)ethyl]-9-(2,4,6-trimethylphenyl)-4-pyrimido[4,5-b]indolamine IUPAC Name: 2-methyl-N-(2-pyrrolidin-1-ylethyl)-9-(2,4,6-trimethylphenyl)pyrimido[4,5-b]indol-4-amine Traditional Name: (9-mesityl-2-methyl-pyrimid[4,5-b]indol-4-yl)-(2-pyrrolidinoethyl)amine Formula: C26H31N5 MolecularWeight: 413.55784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C3=CC=CC=C3C4=C2N=C(N=C4NCCN5CCCC5)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C3=CC=CC=C3C4=C2N=C(N=C4NCCN5CCCC5)C)C

InChI

InChI=1S/C26H31N5/c1-17-15-18(2)24(19(3)16-17)31-22-10-6-5-9-21(22)23-25(28-20(4)29-26(23)31)27-11-14-30-12-7-8-13-30/h5-6,9-10,15-16H,7-8,11-14H2,1-4H3,(H,27,28,29)