2-[[6-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[[6-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[6-[(4,6-dimorpholino-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetamide CAS Name: 2-[[6-[[4,6-bis(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-1,3-benzothiazol-2-yl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[6-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetamide Traditional Name: N-benzyl-2-[[6-[(4,6-dimorpholino-s-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]thio]acetamide Formula: C27H30N8O3S2 MolecularWeight: 578.7089

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=C(S4)SCC(=O)NCC5=CC=CC=C5)N6CCOCC6

Isomeric SMILES

C1COCCN1C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=C(S4)SCC(=O)NCC5=CC=CC=C5)N6CCOCC6

InChI

InChI=1S/C27H30N8O3S2/c36-23(28-17-19-4-2-1-3-5-19)18-39-27-30-21-7-6-20(16-22(21)40-27)29-24-31-25(34-8-12-37-13-9-34)33-26(32-24)35-10-14-38-15-11-35/h1-7,16H,8-15,17-18H2,(H,28,36)(H,29,31,32,33)