N-[3-oxidanylidene-3-[[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]propyl]benzamide

Systemtic Name: N-[3-oxidanylidene-3-[[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]propyl]benzamide Openeye Name: N-[3-oxo-3-[[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]propyl]benzamide CAS Name: N-[3-oxo-3-[[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]amino]propyl]benzamide IUPAC Name: N-[3-oxo-3-[[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]propyl]benzamide Traditional Name: N-[3-keto-3-[[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]amino]propyl]benzamide Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCSC2=NN=C(S2)NC(=O)CCNC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCSC2=NN=C(S2)NC(=O)CCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S2/c26-18(13-14-22-19(27)17-11-5-2-6-12-17)23-20-24-25-21(29-20)28-15-7-10-16-8-3-1-4-9-16/h1-6,8-9,11-12H,7,10,13-15H2,(H,22,27)(H,23,24,26)