3-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]pyrazine-2-carboxamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholino-ethyl]pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholinyl)ethyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholino-ethyl]pyrazinamide Formula: C25H25N5O3S MolecularWeight: 475.5627

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3)N5CCOCC5

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3)N5CCOCC5

InChI

InChI=1S/C25H25N5O3S/c1-32-18-8-6-17(7-9-18)20(30-12-14-33-15-13-30)16-28-24(31)22-23(27-11-10-26-22)25-29-19-4-2-3-5-21(19)34-25/h2-11,20H,12-16H2,1H3,(H,28,31)/t20-/m0/s1