N-aminocarbonyl-3-methyl-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]butanamide

Systemtic Name: N-aminocarbonyl-3-methyl-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]butanamide Openeye Name: N-carbamoyl-3-methyl-2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: N-carbamoyl-3-methyl-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]butanamide IUPAC Name: N-carbamoyl-3-methyl-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: N-carbamoyl-3-methyl-2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]butyramide Formula: C18H19N5O2S2 MolecularWeight: 401.50576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=NN=C(N1C2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)SC1=NN=C(N1C2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C18H19N5O2S2/c1-11(2)14(16(24)20-17(19)25)27-18-22-21-15(13-9-6-10-26-13)23(18)12-7-4-3-5-8-12/h3-11,14H,1-2H3,(H3,19,20,24,25)