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

Systemtic Name: 2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(ethylcarbamoyl)propanamide Openeye Name: 2-[[4-(3-amino-3-oxo-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(ethylcarbamoyl)propanamide CAS Name: 2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-N-(ethylcarbamoyl)propanamide IUPAC Name: 2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(ethylcarbamoyl)propanamide Traditional Name: 2-[[4-(3-amino-3-keto-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(ethylcarbamoyl)propionamide Formula: C15H20N6O3S2 MolecularWeight: 396.4877

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)SC1=NN=C(N1CCC(=O)N)C2=CC=CS2

Isomeric SMILES

CCNC(=O)NC(=O)C(C)SC1=NN=C(N1CCC(=O)N)C2=CC=CS2

InChI

InChI=1S/C15H20N6O3S2/c1-3-17-14(24)18-13(23)9(2)26-15-20-19-12(10-5-4-8-25-10)21(15)7-6-11(16)22/h4-5,8-9H,3,6-7H2,1-2H3,(H2,16,22)(H2,17,18,23,24)