1-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(4-allyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperidine-4-carboxamide CAS Name: 1-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-methyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-[(4-allyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]isonipecotamide Formula: C13H21N5OS MolecularWeight: 295.40374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1CC=C)CN2CCC(CC2)C(=O)N

Isomeric SMILES

CC1=NN(C(=S)N1CC=C)CN2CCC(CC2)C(=O)N

InChI

InChI=1S/C13H21N5OS/c1-3-6-17-10(2)15-18(13(17)20)9-16-7-4-11(5-8-16)12(14)19/h3,11H,1,4-9H2,2H3,(H2,14,19)