[2-(1,3-benzothiazol-2-yl)phenyl]-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2-(1,3-benzothiazol-2-yl)phenyl]-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: [2-(1,3-benzothiazol-2-yl)phenyl]-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: [2-(1,3-benzothiazol-2-yl)phenyl]-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2-(1,3-benzothiazol-2-yl)phenyl]-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: [2-(1,3-benzothiazol-2-yl)phenyl]-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C21H24N3OS+ MolecularWeight: 366.49976

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H23N3OS/c1-2-11-23-12-14-24(15-13-23)21(25)17-8-4-3-7-16(17)20-22-18-9-5-6-10-19(18)26-20/h3-10H,2,11-15H2,1H3/p+1