N-(1,3-benzothiazol-2-ylmethyl)-4-[(5-bromanylthiophen-2-yl)methoxy]-3-methoxy-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(5-bromanylthiophen-2-yl)methoxy]-3-methoxy-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(5-bromo-2-thienyl)methoxy]-3-methoxy-benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(5-bromo-2-thiophenyl)methoxy]-3-methoxybenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(5-bromothiophen-2-yl)methoxy]-3-methoxybenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(5-bromo-2-thienyl)methoxy]-3-methoxy-benzamide Formula: C21H17BrN2O3S2 MolecularWeight: 489.40528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NCC2=NC3=CC=CC=C3S2)OCC4=CC=C(S4)Br

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NCC2=NC3=CC=CC=C3S2)OCC4=CC=C(S4)Br

InChI

InChI=1S/C21H17BrN2O3S2/c1-26-17-10-13(6-8-16(17)27-12-14-7-9-19(22)28-14)21(25)23-11-20-24-15-4-2-3-5-18(15)29-20/h2-10H,11-12H2,1H3,(H,23,25)