3-[4-cyclopropyl-1-[[(5-methylthiophen-2-yl)methyl-phenethyl-amino]methyl]-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-cyclopropyl-1-[[(5-methylthiophen-2-yl)methyl-phenethyl-amino]methyl]-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-1-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-1-[[(5-methyl-2-thiophenyl)methyl-phenethylamino]methyl]-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-1-[[(5-methylthiophen-2-yl)methyl-phenethylamino]methyl]-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-1-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C23H29N5OS2 MolecularWeight: 455.63926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)CN3C(=S)N(C(=N3)CCC(=O)N)C4CC4

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)CN3C(=S)N(C(=N3)CCC(=O)N)C4CC4

InChI

InChI=1S/C23H29N5OS2/c1-17-7-10-20(31-17)15-26(14-13-18-5-3-2-4-6-18)16-27-23(30)28(19-8-9-19)22(25-27)12-11-21(24)29/h2-7,10,19H,8-9,11-16H2,1H3,(H2,24,29)