2-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide hydrochloride

Systemtic Name: 2-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide hydrochloride Openeye Name: 2-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)pyrazole-3-carboxamide hydrochloride CAS Name: 2-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-3-pyrazolecarboxamide hydrochloride IUPAC Name: 2-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide hydrochloride Traditional Name: 2-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)pyrazole-3-carboxamide hydrochloride Formula: C21H28ClN5O2S MolecularWeight: 449.99732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)C.Cl

Isomeric SMILES

CCN1C(=CC=N1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)C.Cl

InChI

InChI=1S/C21H27N5O2S.ClH/c1-3-26-18(7-8-22-26)20(27)25(10-4-9-24-11-13-28-14-12-24)21-23-17-6-5-16(2)15-19(17)29-21;/h5-8,15H,3-4,9-14H2,1-2H3;1H