(phenylmethyl) N-[6-[(2-methyl-1,3-benzothiazol-5-yl)amino]-6-oxidanylidene-hexyl]carbamate

Systemtic Name: (phenylmethyl) N-[6-[(2-methyl-1,3-benzothiazol-5-yl)amino]-6-oxidanylidene-hexyl]carbamate Openeye Name: benzyl N-[6-[(2-methyl-1,3-benzothiazol-5-yl)amino]-6-oxo-hexyl]carbamate CAS Name: N-[6-[(2-methyl-1,3-benzothiazol-5-yl)amino]-6-oxohexyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[6-[(2-methyl-1,3-benzothiazol-5-yl)amino]-6-oxohexyl]carbamate Traditional Name: N-[6-keto-6-[(2-methyl-1,3-benzothiazol-5-yl)amino]hexyl]carbamic acid benzyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)NC(=O)CCCCCNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)NC(=O)CCCCCNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3S/c1-16-24-19-14-18(11-12-20(19)29-16)25-21(26)10-6-3-7-13-23-22(27)28-15-17-8-4-2-5-9-17/h2,4-5,8-9,11-12,14H,3,6-7,10,13,15H2,1H3,(H,23,27)(H,25,26)