N-(butylcarbamoyl)-2-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(butylcarbamoyl)-2-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-allyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(butylcarbamoyl)propanamide CAS Name: N-[butylamino(oxo)methyl]-2-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(butylcarbamoyl)-2-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(4-allyl-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(butylcarbamoyl)propionamide Formula: C16H25N5O2S MolecularWeight: 351.467

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)C(C)SC1=NN=C(N1CC=C)C2CC2

Isomeric SMILES

CCCCNC(=O)NC(=O)C(C)SC1=NN=C(N1CC=C)C2CC2

InChI

InChI=1S/C16H25N5O2S/c1-4-6-9-17-15(23)18-14(22)11(3)24-16-20-19-13(12-7-8-12)21(16)10-5-2/h5,11-12H,2,4,6-10H2,1,3H3,(H2,17,18,22,23)