2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(5-bromanylthiophen-2-yl)methyl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(5-bromanylthiophen-2-yl)methyl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[(5-bromo-2-thienyl)methyl]acetamide CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-[(5-bromo-2-thiophenyl)methyl]-N-prop-2-enylacetamide IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[(5-bromothiophen-2-yl)methyl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-[(5-bromo-2-thienyl)methyl]acetamide Formula: C12H14BrN5OS2 MolecularWeight: 388.30646

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Br)C(=O)CSC2=NN=CN2N

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Br)C(=O)CSC2=NN=CN2N

InChI

InChI=1S/C12H14BrN5OS2/c1-2-5-17(6-9-3-4-10(13)21-9)11(19)7-20-12-16-15-8-18(12)14/h2-4,8H,1,5-7,14H2