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

Systemtic Name: (2S)-N-(cyclopropylcarbamoyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2S)-2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-(cyclopropylcarbamoyl)propanamide CAS Name: (2S)-N-[(cyclopropylamino)-oxomethyl]-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2S)-N-(cyclopropylcarbamoyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2S)-2-[(4-allyl-1,2,4-triazol-3-yl)thio]-N-(cyclopropylcarbamoyl)propionamide Formula: C12H17N5O2S MolecularWeight: 295.36068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)SC2=NN=CN2CC=C

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC1CC1)SC2=NN=CN2CC=C

InChI

InChI=1S/C12H17N5O2S/c1-3-6-17-7-13-16-12(17)20-8(2)10(18)15-11(19)14-9-4-5-9/h3,7-9H,1,4-6H2,2H3,(H2,14,15,18,19)/t8-/m0/s1