(2R)-2-[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-propyl-propanamide

Systemtic Name: (2R)-2-[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-propyl-propanamide Openeye Name: (2R)-2-[[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-propyl-propanamide CAS Name: (2R)-2-[[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-propylpropanamide IUPAC Name: (2R)-2-[[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-propylpropanamide Traditional Name: (2R)-2-[[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-propyl-propionamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CSC1=NN(C(=N1)C2CC2)C3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)[C@@H](C)NC(=O)CSC1=NN(C(=N1)C2CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H25N5O2S/c1-3-11-20-18(26)13(2)21-16(25)12-27-19-22-17(14-9-10-14)24(23-19)15-7-5-4-6-8-15/h4-8,13-14H,3,9-12H2,1-2H3,(H,20,26)(H,21,25)/t13-/m1/s1