dodecyl 3-[[[3-(phenylsulfinyl)-1,2,4-thiadiazol-5-yl]amino]carbamoylamino]propanoate

Systemtic Name: dodecyl 3-[[[3-(phenylsulfinyl)-1,2,4-thiadiazol-5-yl]amino]carbamoylamino]propanoate Openeye Name: dodecyl 3-[[[3-(benzenesulfinyl)-1,2,4-thiadiazol-5-yl]amino]carbamoylamino]propanoate CAS Name: 3-[[[[3-(benzenesulfinyl)-1,2,4-thiadiazol-5-yl]hydrazo]-oxomethyl]amino]propanoic acid dodecyl ester IUPAC Name: dodecyl 3-[[[3-(benzenesulfinyl)-1,2,4-thiadiazol-5-yl]amino]carbamoylamino]propanoate Traditional Name: 3-[[[3-(benzenesulfinyl)-1,2,4-thiadiazol-5-yl]amino]carbamoylamino]propionic acid lauryl ester Formula: C24H37N5O4S2 MolecularWeight: 523.71168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CCNC(=O)NNC1=NC(=NS1)S(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CCNC(=O)NNC1=NC(=NS1)S(=O)C2=CC=CC=C2

InChI

InChI=1S/C24H37N5O4S2/c1-2-3-4-5-6-7-8-9-10-14-19-33-21(30)17-18-25-22(31)27-28-23-26-24(29-34-23)35(32)20-15-12-11-13-16-20/h11-13,15-16H,2-10,14,17-19H2,1H3,(H2,25,27,31)(H,26,28,29)