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

Systemtic Name: tert-butyl N-[[4-[(6-butyl-1,3-benzothiazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[(6-butyl-1,3-benzothiazol-2-yl)carbamoyl]thiazol-2-yl]methyl]carbamate CAS Name: N-[[4-[[(6-butyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]-2-thiazolyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[(6-butyl-1,3-benzothiazol-2-yl)carbamoyl]-1,3-thiazol-2-yl]methyl]carbamate Traditional Name: N-[[4-[(6-butyl-1,3-benzothiazol-2-yl)carbamoyl]thiazol-2-yl]methyl]carbamic acid tert-butyl ester Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)CNC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C21H26N4O3S2/c1-5-6-7-13-8-9-14-16(10-13)30-19(24-14)25-18(26)15-12-29-17(23-15)11-22-20(27)28-21(2,3)4/h8-10,12H,5-7,11H2,1-4H3,(H,22,27)(H,24,25,26)