N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[2-methyl-4-(4-methylpiperazino)phenyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C19H28N6OS MolecularWeight: 388.53022

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C

InChI

InChI=1S/C19H28N6OS/c1-4-5-17-21-22-19(27)25(17)13-18(26)20-16-7-6-15(12-14(16)2)24-10-8-23(3)9-11-24/h6-7,12H,4-5,8-11,13H2,1-3H3,(H,20,26)(H,22,27)