N-[4-[[4,6-bis[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]-2-oxidanyl-phenyl]naphthalene-2-carboxamide

Systemtic Name: N-[4-[[4,6-bis[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]-2-oxidanyl-phenyl]naphthalene-2-carboxamide Openeye Name: N-[4-[[4,6-bis(3,5-diamino-1-piperidyl)-1,3,5-triazin-2-yl]amino]-2-hydroxy-phenyl]naphthalene-2-carboxamide CAS Name: N-[4-[[4,6-bis(3,5-diamino-1-piperidinyl)-1,3,5-triazin-2-yl]amino]-2-hydroxyphenyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-[[4,6-bis(3,5-diaminopiperidin-1-yl)-1,3,5-triazin-2-yl]amino]-2-hydroxyphenyl]naphthalene-2-carboxamide Traditional Name: N-[4-[[4,6-bis(3,5-diaminopiperidino)-s-triazin-2-yl]amino]-2-hydroxy-phenyl]-2-naphthamide Formula: C30H37N11O2 MolecularWeight: 583.68728

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC1N)C2=NC(=NC(=N2)NC3=CC(=C(C=C3)NC(=O)C4=CC5=CC=CC=C5C=C4)O)N6CC(CC(C6)N)N)N

Isomeric SMILES

C1C(CN(CC1N)C2=NC(=NC(=N2)NC3=CC(=C(C=C3)NC(=O)C4=CC5=CC=CC=C5C=C4)O)N6CC(CC(C6)N)N)N

InChI

InChI=1S/C30H37N11O2/c31-20-10-21(32)14-40(13-20)29-37-28(38-30(39-29)41-15-22(33)11-23(34)16-41)35-24-7-8-25(26(42)12-24)36-27(43)19-6-5-17-3-1-2-4-18(17)9-19/h1-9,12,20-23,42H,10-11,13-16,31-34H2,(H,36,43)(H,35,37,38,39)