2-[[5-(3-azanyl-3-oxidanylidene-propyl)-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide

Systemtic Name: 2-[[5-(3-azanyl-3-oxidanylidene-propyl)-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide Openeye Name: 2-[[5-(3-amino-3-oxo-propyl)-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(isobutylcarbamoyl)propanamide CAS Name: 2-[[5-(3-amino-3-oxopropyl)-4-cyclopropyl-1,2,4-triazol-3-yl]thio]-N-[(2-methylpropylamino)-oxomethyl]propanamide IUPAC Name: 2-[[5-(3-amino-3-oxopropyl)-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide Traditional Name: 2-[[5-(3-amino-3-keto-propyl)-4-cyclopropyl-1,2,4-triazol-3-yl]thio]-N-(isobutylcarbamoyl)propionamide Formula: C16H26N6O3S MolecularWeight: 382.48104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)C(C)SC1=NN=C(N1C2CC2)CCC(=O)N

Isomeric SMILES

CC(C)CNC(=O)NC(=O)C(C)SC1=NN=C(N1C2CC2)CCC(=O)N

InChI

InChI=1S/C16H26N6O3S/c1-9(2)8-18-15(25)19-14(24)10(3)26-16-21-20-13(7-6-12(17)23)22(16)11-4-5-11/h9-11H,4-8H2,1-3H3,(H2,17,23)(H2,18,19,24,25)