N-[2-(1,4-dimethylpyrimido[1,6-a]indol-5-yl)ethyl]-2-methyl-N-pent-4-ynyl-butan-1-amine

Systemtic Name: N-[2-(1,4-dimethylpyrimido[1,6-a]indol-5-yl)ethyl]-2-methyl-N-pent-4-ynyl-butan-1-amine Openeye Name: N-[2-(1,4-dimethylpyrimido[1,6-a]indol-5-yl)ethyl]-2-methyl-N-pent-4-ynyl-butan-1-amine CAS Name: N-[2-(1,4-dimethyl-5-pyrimido[1,6-a]indolyl)ethyl]-2-methyl-N-pent-4-ynyl-1-butanamine IUPAC Name: N-[2-(1,4-dimethylpyrimido[1,6-a]indol-5-yl)ethyl]-2-methyl-N-pent-4-ynylbutan-1-amine Traditional Name: 2-(1,4-dimethylpyrimid[1,6-a]indol-5-yl)ethyl-(2-methylbutyl)-pent-4-ynyl-amine Formula: C25H33N3 MolecularWeight: 375.54962

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN(CCCC#C)CCC1=C2C(=CN=C(N2C3=CC=CC=C31)C)C

Isomeric SMILES

CCC(C)CN(CCCC#C)CCC1=C2C(=CN=C(N2C3=CC=CC=C31)C)C

InChI

InChI=1S/C25H33N3/c1-6-8-11-15-27(18-19(3)7-2)16-14-23-22-12-9-10-13-24(22)28-21(5)26-17-20(4)25(23)28/h1,9-10,12-13,17,19H,7-8,11,14-16,18H2,2-5H3