4-[[4-(cyclohexylmethylamino)-1-oxidanylidene-1,2,5-thiadiazol-3-yl]amino]butanoic acid

Systemtic Name: 4-[[4-(cyclohexylmethylamino)-1-oxidanylidene-1,2,5-thiadiazol-3-yl]amino]butanoic acid Openeye Name: 4-[[4-(cyclohexylmethylamino)-1-oxo-1,2,5-thiadiazol-3-yl]amino]butanoic acid CAS Name: 4-[[4-(cyclohexylmethylamino)-1-oxo-1,2,5-thiadiazol-3-yl]amino]butanoic acid IUPAC Name: 4-[[4-(cyclohexylmethylamino)-1-oxo-1,2,5-thiadiazol-3-yl]amino]butanoic acid Traditional Name: 4-[[4-(cyclohexylmethylamino)-1-keto-1,2,5-thiadiazol-3-yl]amino]butyric acid Formula: C13H22N4O3S MolecularWeight: 314.40378

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC2=NS(=O)N=C2NCCCC(=O)O

Isomeric SMILES

C1CCC(CC1)CNC2=NS(=O)N=C2NCCCC(=O)O

InChI

InChI=1S/C13H22N4O3S/c18-11(19)7-4-8-14-12-13(17-21(20)16-12)15-9-10-5-2-1-3-6-10/h10H,1-9H2,(H,14,16)(H,15,17)(H,18,19)