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

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-benzyl-pyrazole-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-benzylpyrazole-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-benzyl-pyrazole-4-carboxamide Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N4OS/c26-21(17-13-23-25(15-17)14-16-7-2-1-3-8-16)22-12-6-11-20-24-18-9-4-5-10-19(18)27-20/h1-5,7-10,13,15H,6,11-12,14H2,(H,22,26)