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

Systemtic Name: N-aminocarbonyl-3-[[5-(furan-2-yl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[4-benzyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoyl-propanamide CAS Name: N-carbamoyl-3-[[5-(2-furanyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[[4-benzyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoylpropanamide Traditional Name: 3-[[4-benzyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-carbamoyl-propionamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCCC(=O)NC(=O)N)C3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCCC(=O)NC(=O)N)C3=CC=CO3

InChI

InChI=1S/C17H17N5O3S/c18-16(24)19-14(23)8-10-26-17-21-20-15(13-7-4-9-25-13)22(17)11-12-5-2-1-3-6-12/h1-7,9H,8,10-11H2,(H3,18,19,23,24)