5-bromanyl-N-[4-(3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-[4-(3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide Openeye Name: N-[4-(4-allyl-3-oxo-1,4-benzoxazin-6-yl)thiazol-2-yl]-5-bromo-thiophene-2-sulfonamide CAS Name: 5-bromo-N-[4-(3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)-2-thiazolyl]-2-thiophenesulfonamide IUPAC Name: 5-bromo-N-[4-(3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide Traditional Name: N-[4-(4-allyl-3-keto-1,4-benzoxazin-6-yl)thiazol-2-yl]-5-bromo-thiophene-2-sulfonamide Formula: C18H14BrN3O4S3 MolecularWeight: 512.42046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)COC2=C1C=C(C=C2)C3=CSC(=N3)NS(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C=CCN1C(=O)COC2=C1C=C(C=C2)C3=CSC(=N3)NS(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C18H14BrN3O4S3/c1-2-7-22-13-8-11(3-4-14(13)26-9-16(22)23)12-10-27-18(20-12)21-29(24,25)17-6-5-15(19)28-17/h2-6,8,10H,1,7,9H2,(H,20,21)