[4-[(2-azanyl-4-methylsulfanyl-butanoyl)amino]-3-(ethylsulfonylmethyl)cyclohexyl]carbamic acid

Systemtic Name: [4-[(2-azanyl-4-methylsulfanyl-butanoyl)amino]-3-(ethylsulfonylmethyl)cyclohexyl]carbamic acid Openeye Name: [4-[(2-amino-4-methylsulfanyl-butanoyl)amino]-3-(ethylsulfonylmethyl)cyclohexyl]carbamic acid CAS Name: [4-[[2-amino-4-(methylthio)-1-oxobutyl]amino]-3-(ethylsulfonylmethyl)cyclohexyl]carbamic acid IUPAC Name: [4-[(2-amino-4-methylsulfanylbutanoyl)amino]-3-(ethylsulfonylmethyl)cyclohexyl]carbamic acid Traditional Name: [4-[[2-amino-4-(methylthio)butanoyl]amino]-3-(esylmethyl)cyclohexyl]carbamic acid Formula: C15H29N3O5S2 MolecularWeight: 395.53786

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CC1CC(CCC1NC(=O)C(CCSC)N)NC(=O)O

Isomeric SMILES

CCS(=O)(=O)CC1CC(CCC1NC(=O)C(CCSC)N)NC(=O)O

InChI

InChI=1S/C15H29N3O5S2/c1-3-25(22,23)9-10-8-11(17-15(20)21)4-5-13(10)18-14(19)12(16)6-7-24-2/h10-13,17H,3-9,16H2,1-2H3,(H,18,19)(H,20,21)