(2S)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide Openeye Name: (2S)-2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(isopropylcarbamoyl)propanamide CAS Name: (2S)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[oxo-(propan-2-ylamino)methyl]propanamide IUPAC Name: (2S)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide Traditional Name: (2S)-2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(isopropylcarbamoyl)propionamide Formula: C16H21N5O2S2 MolecularWeight: 379.50024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)SC1=NN=C(N1C2CC2)C3=CC=CS3

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)C)SC1=NN=C(N1C2CC2)C3=CC=CS3

InChI

InChI=1S/C16H21N5O2S2/c1-9(2)17-15(23)18-14(22)10(3)25-16-20-19-13(12-5-4-8-24-12)21(16)11-6-7-11/h4-5,8-11H,6-7H2,1-3H3,(H2,17,18,22,23)/t10-/m0/s1