1-(1,3-benzothiazol-2-ylmethyl)-3-spiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl-urea

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-spiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl-urea Openeye Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-spiro[chromane-2,1'-cyclobutane]-4-yl-urea CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-(4-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclobutane]yl)urea IUPAC Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-spiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-ylurea Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)-3-spiro[chroman-2,1'-cyclobutane]-4-yl-urea Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(C1)CC(C3=CC=CC=C3O2)NC(=O)NCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC2(C1)CC(C3=CC=CC=C3O2)NC(=O)NCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H21N3O2S/c25-20(22-13-19-23-15-7-2-4-9-18(15)27-19)24-16-12-21(10-5-11-21)26-17-8-3-1-6-14(16)17/h1-4,6-9,16H,5,10-13H2,(H2,22,24,25)