2-[(4-azanyl-6-methyl-5-oxidanylidene-1,2,4-triazin-3-yl)sulfanyl]-N-(3,3-diphenylpropyl)ethanamide

Systemtic Name: 2-[(4-azanyl-6-methyl-5-oxidanylidene-1,2,4-triazin-3-yl)sulfanyl]-N-(3,3-diphenylpropyl)ethanamide Openeye Name: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-(3,3-diphenylpropyl)acetamide CAS Name: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)thio]-N-(3,3-diphenylpropyl)acetamide IUPAC Name: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-(3,3-diphenylpropyl)acetamide Traditional Name: 2-[(4-amino-5-keto-6-methyl-1,2,4-triazin-3-yl)thio]-N-(3,3-diphenylpropyl)acetamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N(C1=O)N)SCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N(C1=O)N)SCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N5O2S/c1-15-20(28)26(22)21(25-24-15)29-14-19(27)23-13-12-18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18H,12-14,22H2,1H3,(H,23,27)