N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-benzyl-N-(4-chloro-1,3-benzothiazol-2-yl)-1-isopropyl-pyrazole-3-carboxamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-benzyl-N-(4-chloro-1,3-benzothiazol-2-yl)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-benzyl-N-(4-chloro-1,3-benzothiazol-2-yl)-1-isopropyl-pyrazole-3-carboxamide Formula: C21H19ClN4OS MolecularWeight: 410.91976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CC(=N1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=CC=C4Cl

Isomeric SMILES

CC(C)N1C=CC(=N1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=CC=C4Cl

InChI

InChI=1S/C21H19ClN4OS/c1-14(2)26-12-11-17(24-26)20(27)25(13-15-7-4-3-5-8-15)21-23-19-16(22)9-6-10-18(19)28-21/h3-12,14H,13H2,1-2H3