2-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[(4-anilino-6-morpholino-1,3,5-triazin-2-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[[4-anilino-6-(4-morpholinyl)-1,3,5-triazin-2-yl]thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[(4-anilino-6-morpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(4-anilino-6-morpholino-s-triazin-2-yl)thio]-1-(4-phenylpiperazino)ethanone Formula: C25H29N7O2S MolecularWeight: 491.60846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC(=NC(=N3)NC4=CC=CC=C4)N5CCOCC5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC(=NC(=N3)NC4=CC=CC=C4)N5CCOCC5

InChI

InChI=1S/C25H29N7O2S/c33-22(31-13-11-30(12-14-31)21-9-5-2-6-10-21)19-35-25-28-23(26-20-7-3-1-4-8-20)27-24(29-25)32-15-17-34-18-16-32/h1-10H,11-19H2,(H,26,27,28,29)