1-(4-methylphenyl)carbonyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)piperidine-3-carboxamide

Systemtic Name: 1-(4-methylphenyl)carbonyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)piperidine-3-carboxamide Openeye Name: 1-(4-methylbenzoyl)-N-(2-morpholino-1,3-benzothiazol-6-yl)piperidine-3-carboxamide CAS Name: 1-[(4-methylphenyl)-oxomethyl]-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-3-piperidinecarboxamide IUPAC Name: 1-(4-methylbenzoyl)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)piperidine-3-carboxamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-1-p-toluoyl-nipecotamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5

InChI

InChI=1S/C25H28N4O3S/c1-17-4-6-18(7-5-17)24(31)29-10-2-3-19(16-29)23(30)26-20-8-9-21-22(15-20)33-25(27-21)28-11-13-32-14-12-28/h4-9,15,19H,2-3,10-14,16H2,1H3,(H,26,30)