4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[3-(cyclopropylcarbonylamino)phenyl]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[3-(cyclopropylcarbonylamino)phenyl]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[3-(cyclopropanecarbonylamino)phenyl]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[3-[[cyclopropyl(oxo)methyl]amino]phenyl]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[3-(cyclopropanecarbonylamino)phenyl]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[3-(cyclopropanecarbonylamino)phenyl]benzamide Formula: C25H21N3O2S2 MolecularWeight: 459.58314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H21N3O2S2/c29-23(26-19-4-3-5-20(14-19)27-24(30)18-12-13-18)17-10-8-16(9-11-17)15-31-25-28-21-6-1-2-7-22(21)32-25/h1-11,14,18H,12-13,15H2,(H,26,29)(H,27,30)