1-(1,3-benzothiazol-2-yl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-[3-(4-phenyl-1-piperazinyl)propyl]urea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-[3-(4-phenylpiperazino)propyl]urea Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)NC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCNC(=O)NC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C21H25N5OS/c27-20(24-21-23-18-9-4-5-10-19(18)28-21)22-11-6-12-25-13-15-26(16-14-25)17-7-2-1-3-8-17/h1-5,7-10H,6,11-16H2,(H2,22,23,24,27)