N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methoxyphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methoxyphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C=C2C(=O)NCCCC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C=C2C(=O)NCCCC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C27H24N4O2S/c1-33-23-14-7-5-12-20(23)26-21(18-31(30-26)19-10-3-2-4-11-19)27(32)28-17-9-16-25-29-22-13-6-8-15-24(22)34-25/h2-8,10-15,18H,9,16-17H2,1H3,(H,28,32)