1-[4-[3,5-bis(azanyl)piperidin-1-yl]-6-[(3-morpholin-4-yl-2-morpholin-4-ylsulfonyl-phenyl)amino]-1,3,5-triazin-2-yl]piperidine-3,5-diamine

Systemtic Name: 1-[4-[3,5-bis(azanyl)piperidin-1-yl]-6-[(3-morpholin-4-yl-2-morpholin-4-ylsulfonyl-phenyl)amino]-1,3,5-triazin-2-yl]piperidine-3,5-diamine Openeye Name: 1-[4-(3,5-diamino-1-piperidyl)-6-(3-morpholino-2-morpholinosulfonyl-anilino)-1,3,5-triazin-2-yl]piperidine-3,5-diamine CAS Name: 1-[4-(3,5-diamino-1-piperidinyl)-6-[3-(4-morpholinyl)-2-(4-morpholinylsulfonyl)anilino]-1,3,5-triazin-2-yl]piperidine-3,5-diamine IUPAC Name: 1-[4-(3,5-diaminopiperidin-1-yl)-6-(3-morpholin-4-yl-2-morpholin-4-ylsulfonylanilino)-1,3,5-triazin-2-yl]piperidine-3,5-diamine Traditional Name: [4,6-bis(3,5-diaminopiperidino)-s-triazin-2-yl]-(3-morpholino-2-morpholinosulfonyl-phenyl)amine Formula: C27H44N12O4S MolecularWeight: 632.78126

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=CC=C2)NC3=NC(=NC(=N3)N4CC(CC(C4)N)N)N5CC(CC(C5)N)N)S(=O)(=O)N6CCOCC6

Isomeric SMILES

C1COCCN1C2=C(C(=CC=C2)NC3=NC(=NC(=N3)N4CC(CC(C4)N)N)N5CC(CC(C5)N)N)S(=O)(=O)N6CCOCC6

InChI

InChI=1S/C27H44N12O4S/c28-18-12-19(29)15-37(14-18)26-33-25(34-27(35-26)38-16-20(30)13-21(31)17-38)32-22-2-1-3-23(36-4-8-42-9-5-36)24(22)44(40,41)39-6-10-43-11-7-39/h1-3,18-21H,4-17,28-31H2,(H,32,33,34,35)