2-azanyl-3-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-[1-cyclohexenyl(cyclopropyl)amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-keto-ethyl]thio]propionic acid Formula: C14H22N2O3S MolecularWeight: 298.40108

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)N(C2CC2)C(=O)CSCC(C(=O)O)N

Isomeric SMILES

C1CCC(=CC1)N(C2CC2)C(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C14H22N2O3S/c15-12(14(18)19)8-20-9-13(17)16(11-6-7-11)10-4-2-1-3-5-10/h4,11-12H,1-3,5-9,15H2,(H,18,19)