2-[methyl-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]-N-propyl-ethanamide

Systemtic Name: 2-[methyl-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]-N-propyl-ethanamide Openeye Name: 2-[(4-allyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]-N-propyl-acetamide CAS Name: 2-[methyl-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]-N-propylacetamide IUPAC Name: 2-[methyl-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]-N-propylacetamide Traditional Name: 2-[(4-allyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]-N-propyl-acetamide Formula: C13H23N5OS MolecularWeight: 297.41962

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)CN1C(=S)N(C(=N1)C)CC=C

Isomeric SMILES

CCCNC(=O)CN(C)CN1C(=S)N(C(=N1)C)CC=C

InChI

InChI=1S/C13H23N5OS/c1-5-7-14-12(19)9-16(4)10-18-13(20)17(8-6-2)11(3)15-18/h6H,2,5,7-10H2,1,3-4H3,(H,14,19)