methyl 2-[[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]carbamoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]carbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]carbamoylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[[1-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-pyrazolyl]amino]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]carbamoylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]carbamoylamino]-4-(methylthio)butyric acid methyl ester Formula: C16H23N5O4S MolecularWeight: 381.44992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2C=C(C=N2)NC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=C(C(=NO1)C)CN2C=C(C=N2)NC(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C16H23N5O4S/c1-10-13(11(2)25-20-10)9-21-8-12(7-17-21)18-16(23)19-14(5-6-26-4)15(22)24-3/h7-8,14H,5-6,9H2,1-4H3,(H2,18,19,23)