N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)C(=O)C=CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)C(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C26H28N4O3S/c31-24(9-6-19-4-2-1-3-5-19)29-12-10-20(11-13-29)25(32)27-21-7-8-22-23(18-21)34-26(28-22)30-14-16-33-17-15-30/h1-9,18,20H,10-17H2,(H,27,32)/b9-6+