2-[[4,6-bis[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]-3-(1H-indol-3-yl)propanamide

Systemtic Name: 2-[[4,6-bis[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]-3-(1H-indol-3-yl)propanamide Openeye Name: 2-[[4,6-bis(3,5-diamino-1-piperidyl)-1,3,5-triazin-2-yl]amino]-3-(1H-indol-3-yl)propanamide CAS Name: 2-[[4,6-bis(3,5-diamino-1-piperidinyl)-1,3,5-triazin-2-yl]amino]-3-(1H-indol-3-yl)propanamide IUPAC Name: 2-[[4,6-bis(3,5-diaminopiperidin-1-yl)-1,3,5-triazin-2-yl]amino]-3-(1H-indol-3-yl)propanamide Traditional Name: 2-[[4,6-bis(3,5-diaminopiperidino)-s-triazin-2-yl]amino]-3-(1H-indol-3-yl)propionamide Formula: C24H36N12O MolecularWeight: 508.62244

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC1N)C2=NC(=NC(=N2)NC(CC3=CNC4=CC=CC=C43)C(=O)N)N5CC(CC(C5)N)N)N

Isomeric SMILES

C1C(CN(CC1N)C2=NC(=NC(=N2)NC(CC3=CNC4=CC=CC=C43)C(=O)N)N5CC(CC(C5)N)N)N

InChI

InChI=1S/C24H36N12O/c25-14-6-15(26)10-35(9-14)23-32-22(33-24(34-23)36-11-16(27)7-17(28)12-36)31-20(21(29)37)5-13-8-30-19-4-2-1-3-18(13)19/h1-4,8,14-17,20,30H,5-7,9-12,25-28H2,(H2,29,37)(H,31,32,33,34)