N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-carboxamide

Systemtic Name: N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-carboxamide Openeye Name: N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide CAS Name: N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide IUPAC Name: N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide Traditional Name: N-[2-[(5-bromo-2-thienyl)methylthio]ethyl]-3-keto-4H-1,4-benzoxazine-7-carboxamide Formula: C16H15BrN2O3S2 MolecularWeight: 427.3359

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=C(C=C2)C(=O)NCCSCC3=CC=C(S3)Br

Isomeric SMILES

C1C(=O)NC2=C(O1)C=C(C=C2)C(=O)NCCSCC3=CC=C(S3)Br

InChI

InChI=1S/C16H15BrN2O3S2/c17-14-4-2-11(24-14)9-23-6-5-18-16(21)10-1-3-12-13(7-10)22-8-15(20)19-12/h1-4,7H,5-6,8-9H2,(H,18,21)(H,19,20)