2-[2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]propanoylamino]thiophene-3-carboxamide Formula: C18H19N5O2S2 MolecularWeight: 401.50576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)SC2=NN=C(N2C)CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C(=O)N)SC2=NN=C(N2C)CC3=CC=CC=C3

InChI

InChI=1S/C18H19N5O2S2/c1-11(16(25)20-17-13(15(19)24)8-9-26-17)27-18-22-21-14(23(18)2)10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H2,19,24)(H,20,25)