2-[[5-[4-(diethylamino)phenyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide

Systemtic Name: 2-[[5-[4-(diethylamino)phenyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide Openeye Name: 2-[[5-[4-(diethylamino)phenyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide CAS Name: 2-[[5-[4-(diethylamino)phenyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-propylpropanamide IUPAC Name: 2-[[5-[4-(diethylamino)phenyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-propylpropanamide Traditional Name: 2-[[5-[4-(diethylamino)phenyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-propyl-propionamide Formula: C19H29N5OS MolecularWeight: 375.53146

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NN=C(N1C)C2=CC=C(C=C2)N(CC)CC

Isomeric SMILES

CCCNC(=O)C(C)SC1=NN=C(N1C)C2=CC=C(C=C2)N(CC)CC

InChI

InChI=1S/C19H29N5OS/c1-6-13-20-18(25)14(4)26-19-22-21-17(23(19)5)15-9-11-16(12-10-15)24(7-2)8-3/h9-12,14H,6-8,13H2,1-5H3,(H,20,25)