N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-4-butoxy-benzamide

Systemtic Name: N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-4-butoxy-benzamide Openeye Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-4-butoxy-benzamide CAS Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-4-butoxybenzamide IUPAC Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-4-butoxybenzamide Traditional Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-4-butoxy-benzamide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CC

InChI

InChI=1S/C20H21BrN2O2S/c1-3-5-12-25-16-9-6-14(7-10-16)19(24)22-20-23(4-2)17-11-8-15(21)13-18(17)26-20/h6-11,13H,3-5,12H2,1-2H3