tert-butyl N-[2-[(7-aminocarbonyl-5-chloranyl-1,2-benzoxazol-3-yl)sulfanyl]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[(7-aminocarbonyl-5-chloranyl-1,2-benzoxazol-3-yl)sulfanyl]ethyl]carbamate Openeye Name: tert-butyl N-[2-[(7-carbamoyl-5-chloro-1,2-benzoxazol-3-yl)sulfanyl]ethyl]carbamate CAS Name: N-[2-[(7-carbamoyl-5-chloro-1,2-benzoxazol-3-yl)thio]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[(7-carbamoyl-5-chloro-1,2-benzoxazol-3-yl)sulfanyl]ethyl]carbamate Traditional Name: N-[2-[(7-carbamoyl-5-chloro-indoxazen-3-yl)thio]ethyl]carbamic acid tert-butyl ester Formula: C15H18ClN3O4S MolecularWeight: 371.83912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCSC1=NOC2=C(C=C(C=C21)Cl)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NCCSC1=NOC2=C(C=C(C=C21)Cl)C(=O)N

InChI

InChI=1S/C15H18ClN3O4S/c1-15(2,3)22-14(21)18-4-5-24-13-10-7-8(16)6-9(12(17)20)11(10)23-19-13/h6-7H,4-5H2,1-3H3,(H2,17,20)(H,18,21)