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

Systemtic Name: N-(phenylmethyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-benzyl-propanamide CAS Name: N-(phenylmethyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-benzyl-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(4-allyl-1,2,4-triazol-3-yl)thio]-N-benzyl-propionamide Formula: C15H18N4OS MolecularWeight: 302.39462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NN=CN2CC=C

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)SC2=NN=CN2CC=C

InChI

InChI=1S/C15H18N4OS/c1-3-9-19-11-17-18-15(19)21-12(2)14(20)16-10-13-7-5-4-6-8-13/h3-8,11-12H,1,9-10H2,2H3,(H,16,20)