N-(1,3-benzothiazol-2-yl)-3-(3-methylphenyl)-N-(oxolan-2-ylmethyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(3-methylphenyl)-N-(oxolan-2-ylmethyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-(m-tolyl)-1-phenyl-N-(tetrahydrofuran-2-ylmethyl)pyrazole-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-(3-methylphenyl)-N-(2-oxolanylmethyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-(3-methylphenyl)-N-(oxolan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-(m-tolyl)-1-phenyl-N-(tetrahydrofurfuryl)pyrazole-4-carboxamide Formula: C29H26N4O2S MolecularWeight: 494.60734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN(C=C2C(=O)N(CC3CCCO3)C4=NC5=CC=CC=C5S4)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN(C=C2C(=O)N(CC3CCCO3)C4=NC5=CC=CC=C5S4)C6=CC=CC=C6

InChI

InChI=1S/C29H26N4O2S/c1-20-9-7-10-21(17-20)27-24(19-33(31-27)22-11-3-2-4-12-22)28(34)32(18-23-13-8-16-35-23)29-30-25-14-5-6-15-26(25)36-29/h2-7,9-12,14-15,17,19,23H,8,13,16,18H2,1H3