tert-butyl N-[4-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]phenyl]carbamate CAS Name: N-[4-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]phenyl]carbamate Traditional Name: N-[4-[2-keto-2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl]phenyl]carbamic acid tert-butyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)OC

InChI

InChI=1S/C21H23N3O4S/c1-21(2,3)28-20(26)22-14-7-5-13(6-8-14)11-18(25)24-19-23-16-10-9-15(27-4)12-17(16)29-19/h5-10,12H,11H2,1-4H3,(H,22,26)(H,23,24,25)