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

Systemtic Name: methyl 4-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]butanoate Openeye Name: methyl 4-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]butanoate CAS Name: 4-[[(3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carbonyl)amino]butanoate Traditional Name: 4-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]butyric acid methyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O3S/c1-12-14-11-15(17(23)19-10-6-9-16(22)24-2)25-18(14)21(20-12)13-7-4-3-5-8-13/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,19,23)