1-(1,3-benzothiazol-2-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]urea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(pyrrolidinomethyl)benzyl]urea Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC=C2CNC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCN(C1)CC2=CC=CC=C2CNC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H22N4OS/c25-19(23-20-22-17-9-3-4-10-18(17)26-20)21-13-15-7-1-2-8-16(15)14-24-11-5-6-12-24/h1-4,7-10H,5-6,11-14H2,(H2,21,22,23,25)