4-bromanyl-N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: 4-bromanyl-N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: 4-bromo-N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-methoxy-naphthalene-2-carboxamide CAS Name: 4-bromo-3-methoxy-N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]-2-naphthalenecarboxamide IUPAC Name: 4-bromo-N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-methoxynaphthalene-2-carboxamide Traditional Name: 4-bromo-N-(2-butyramido-1,3-benzothiazol-6-yl)-3-methoxy-2-naphthamide Formula: C23H20BrN3O3S MolecularWeight: 498.3922

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C(=C3OC)Br

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C(=C3OC)Br

InChI

InChI=1S/C23H20BrN3O3S/c1-3-6-19(28)27-23-26-17-10-9-14(12-18(17)31-23)25-22(29)16-11-13-7-4-5-8-15(13)20(24)21(16)30-2/h4-5,7-12H,3,6H2,1-2H3,(H,25,29)(H,26,27,28)