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

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-1,4-dimethyl-pyrazole-3-carboxamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-1,4-dimethyl-pyrazole-3-carboxamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-1,4-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-1,4-dimethylpyrazole-3-carboxamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-1,4-dimethyl-pyrazole-3-carboxamide Formula: C18H22ClN5OS MolecularWeight: 391.91818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1C(=O)N(CCCN(C)C)C2=NC3=C(S2)C=CC=C3Cl)C

Isomeric SMILES

CC1=CN(N=C1C(=O)N(CCCN(C)C)C2=NC3=C(S2)C=CC=C3Cl)C

InChI

InChI=1S/C18H22ClN5OS/c1-12-11-23(4)21-15(12)17(25)24(10-6-9-22(2)3)18-20-16-13(19)7-5-8-14(16)26-18/h5,7-8,11H,6,9-10H2,1-4H3