2-[[5-(3-azanyl-3-oxidanylidene-propyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide

Systemtic Name: 2-[[5-(3-azanyl-3-oxidanylidene-propyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide Openeye Name: 2-[[5-(3-amino-3-oxo-propyl)-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide CAS Name: 2-[[5-(3-amino-3-oxopropyl)-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]-N-cyclopentylpropanamide IUPAC Name: 2-[[5-(3-amino-3-oxopropyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentylpropanamide Traditional Name: 2-[[5-(3-amino-3-keto-propyl)-4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]-N-cyclopentyl-propionamide Formula: C18H25N5O3S MolecularWeight: 391.4878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=NN=C(N2CC3=CC=CO3)CCC(=O)N

Isomeric SMILES

CC(C(=O)NC1CCCC1)SC2=NN=C(N2CC3=CC=CO3)CCC(=O)N

InChI

InChI=1S/C18H25N5O3S/c1-12(17(25)20-13-5-2-3-6-13)27-18-22-21-16(9-8-15(19)24)23(18)11-14-7-4-10-26-14/h4,7,10,12-13H,2-3,5-6,8-9,11H2,1H3,(H2,19,24)(H,20,25)