(2S)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide Openeye Name: (2S)-2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(isopropylcarbamoyl)propanamide CAS Name: (2S)-N-[oxo-(propan-2-ylamino)methyl]-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2S)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide Traditional Name: (2S)-2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-(isopropylcarbamoyl)propionamide Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)SC1=NN=C(N1CC=C)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)C)SC1=NN=C(N1CC=C)C2=CC=CC=C2

InChI

InChI=1S/C18H23N5O2S/c1-5-11-23-15(14-9-7-6-8-10-14)21-22-18(23)26-13(4)16(24)20-17(25)19-12(2)3/h5-10,12-13H,1,11H2,2-4H3,(H2,19,20,24,25)/t13-/m0/s1