2-[ethyl-[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[ethyl-[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-ethyl-amino]-N-isopropyl-acetamide CAS Name: 2-[ethyl-[1-oxo-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[ethyl-[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-propan-2-ylacetamide Traditional Name: 2-[[2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetyl]-ethyl-amino]-N-isopropyl-acetamide Formula: C20H27N5O2S MolecularWeight: 401.52568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(C)C)C(=O)CSC1=NN=C(N1CC=C)C2=CC=CC=C2

Isomeric SMILES

CCN(CC(=O)NC(C)C)C(=O)CSC1=NN=C(N1CC=C)C2=CC=CC=C2

InChI

InChI=1S/C20H27N5O2S/c1-5-12-25-19(16-10-8-7-9-11-16)22-23-20(25)28-14-18(27)24(6-2)13-17(26)21-15(3)4/h5,7-11,15H,1,6,12-14H2,2-4H3,(H,21,26)