[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-(4-phenylpiperazino)methanone Formula: C25H23N3OS2 MolecularWeight: 445.59962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H23N3OS2/c29-24(28-16-14-27(15-17-28)21-6-2-1-3-7-21)20-12-10-19(11-13-20)18-30-25-26-22-8-4-5-9-23(22)31-25/h1-13H,14-18H2