N-aminocarbonyl-2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-aminocarbonyl-2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-carbamoyl-propanamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-carbamoylpropanamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-carbamoylpropanamide Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-carbamoyl-propionamide Formula: C12H20N6O2S MolecularWeight: 312.3912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NN=C(N1N)C2CCCCC2

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NN=C(N1N)C2CCCCC2

InChI

InChI=1S/C12H20N6O2S/c1-7(10(19)15-11(13)20)21-12-17-16-9(18(12)14)8-5-3-2-4-6-8/h7-8H,2-6,14H2,1H3,(H3,13,15,19,20)