methyl (2R)-2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC(CCSC)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)N[C@H](CCSC)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O3S2/c1-12-14-11-16(17(23)20-15(9-10-26-3)19(24)25-2)27-18(14)22(21-12)13-7-5-4-6-8-13/h4-8,11,15H,9-10H2,1-3H3,(H,20,23)/t15-/m1/s1