1-(phenylmethyl)-3-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]thiourea

Systemtic Name: 1-(phenylmethyl)-3-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]thiourea Openeye Name: 1-benzyl-3-[4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanoylamino]thiourea CAS Name: 1-[[1-oxo-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoylamino]thiourea Traditional Name: 1-benzyl-3-[4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanoylamino]thiourea Formula: C18H19N5O2S2 MolecularWeight: 401.50576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC(=O)CCCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC(=O)CCCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C18H19N5O2S2/c24-15(21-22-18(26)19-12-13-6-2-1-3-7-13)9-4-10-16-20-17(23-25-16)14-8-5-11-27-14/h1-3,5-8,11H,4,9-10,12H2,(H,21,24)(H2,19,22,26)