3-(1,3-benzothiazol-2-yl)-N-[3-[(1S)-1-phenylethoxy]propyl]pyrazine-2-carboxamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[3-[(1S)-1-phenylethoxy]propyl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[3-[(1S)-1-phenylethoxy]propyl]pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[3-[(1S)-1-phenylethoxy]propyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[3-[(1S)-1-phenylethoxy]propyl]pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[3-[(1S)-1-phenylethoxy]propyl]pyrazinamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OCCCNC(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

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

InChI

InChI=1S/C23H22N4O2S/c1-16(17-8-3-2-4-9-17)29-15-7-12-26-22(28)20-21(25-14-13-24-20)23-27-18-10-5-6-11-19(18)30-23/h2-6,8-11,13-14,16H,7,12,15H2,1H3,(H,26,28)/t16-/m0/s1