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

Systemtic Name: 2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]ethyl 4-phenylbenzoate Openeye Name: 2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]ethyl 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid 2-[[(3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]amino]ethyl ester IUPAC Name: 2-[(3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carbonyl)amino]ethyl 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid 2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]ethyl ester Formula: C28H23N3O3S MolecularWeight: 481.56552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NCCOC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NCCOC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H23N3O3S/c1-19-24-18-25(35-27(24)31(30-19)23-10-6-3-7-11-23)26(32)29-16-17-34-28(33)22-14-12-21(13-15-22)20-8-4-2-5-9-20/h2-15,18H,16-17H2,1H3,(H,29,32)