3-[2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 3-[[2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]acetyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]acetyl]amino]-N,N-diethyl-benzamide Formula: C23H27N7O2S MolecularWeight: 465.57118

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CSCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CSCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C23H27N7O2S/c1-3-30(4-2)21(32)16-9-8-12-18(13-16)25-20(31)15-33-14-19-27-22(24)29-23(28-19)26-17-10-6-5-7-11-17/h5-13H,3-4,14-15H2,1-2H3,(H,25,31)(H3,24,26,27,28,29)