[4-[3-(butan-2-ylamino)pyridin-2-yl]piperazin-1-yl]-(1H-indol-2-yl)methanone

Systemtic Name: [4-[3-(butan-2-ylamino)pyridin-2-yl]piperazin-1-yl]-(1H-indol-2-yl)methanone Openeye Name: 1H-indol-2-yl-[4-[3-(sec-butylamino)-2-pyridyl]piperazin-1-yl]methanone CAS Name: [4-[3-(butan-2-ylamino)-2-pyridinyl]-1-piperazinyl]-(1H-indol-2-yl)methanone IUPAC Name: [4-[3-(butan-2-ylamino)pyridin-2-yl]piperazin-1-yl]-(1H-indol-2-yl)methanone Traditional Name: 1H-indol-2-yl-[4-[3-(sec-butylamino)-2-pyridyl]piperazino]methanone Formula: C22H27N5O MolecularWeight: 377.48268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CCC(C)NC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C22H27N5O/c1-3-16(2)24-19-9-6-10-23-21(19)26-11-13-27(14-12-26)22(28)20-15-17-7-4-5-8-18(17)25-20/h4-10,15-16,24-25H,3,11-14H2,1-2H3