2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)butanamide

Systemtic Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]butanamide CAS Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: N-benzyl-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]butyramide Formula: C18H24N4OS MolecularWeight: 344.47436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=C(N2CC)C3CC3

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=C(N2CC)C3CC3

InChI

InChI=1S/C18H24N4OS/c1-3-15(17(23)19-12-13-8-6-5-7-9-13)24-18-21-20-16(14-10-11-14)22(18)4-2/h5-9,14-15H,3-4,10-12H2,1-2H3,(H,19,23)