tert-butyl N-[[4-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[(2-methyl-1,3-benzothiazol-6-yl)amino]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C21H23N3O3S/c1-13-23-17-10-9-16(11-18(17)28-13)24-19(25)15-7-5-14(6-8-15)12-22-20(26)27-21(2,3)4/h5-11H,12H2,1-4H3,(H,22,26)(H,24,25)