N-aminocarbonyl-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-aminocarbonyl-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-carbamoyl-propanamide CAS Name: N-carbamoyl-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-carbamoyl-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-carbamoyl-propionamide Formula: C15H17N5O2S MolecularWeight: 331.39278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NN=C(N1CC=C)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NN=C(N1CC=C)C2=CC=CC=C2

InChI

InChI=1S/C15H17N5O2S/c1-3-9-20-12(11-7-5-4-6-8-11)18-19-15(20)23-10(2)13(21)17-14(16)22/h3-8,10H,1,9H2,2H3,(H3,16,17,21,22)