N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-benzyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-1-isopropyl-pyrazole-3-carboxamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-benzyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-benzyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-1-isopropyl-pyrazole-3-carboxamide Formula: C22H21ClN4O2S MolecularWeight: 440.94574

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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(C=CC(=C4S3)Cl)OC

Isomeric SMILES

CC(C)N1C=CC(=N1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(C=CC(=C4S3)Cl)OC

InChI

InChI=1S/C22H21ClN4O2S/c1-14(2)27-12-11-17(25-27)21(28)26(13-15-7-5-4-6-8-15)22-24-19-18(29-3)10-9-16(23)20(19)30-22/h4-12,14H,13H2,1-3H3