2-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide

Systemtic Name: 2-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide Openeye Name: 2-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-benzyl-propanamide CAS Name: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)propanamide IUPAC Name: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-benzylpropanamide Traditional Name: 2-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-benzyl-propionamide Formula: C16H17N5OS2 MolecularWeight: 359.46908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NN=C(N2N)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)SC2=NN=C(N2N)C3=CC=CS3

InChI

InChI=1S/C16H17N5OS2/c1-11(15(22)18-10-12-6-3-2-4-7-12)24-16-20-19-14(21(16)17)13-8-5-9-23-13/h2-9,11H,10,17H2,1H3,(H,18,22)