ethyl 4-[5-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-2-furyl]benzoate CAS Name: 4-[5-[[(6-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-2-furyl]benzoic acid ethyl ester Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C

InChI

InChI=1S/C22H18N2O4S/c1-3-27-21(26)15-7-5-14(6-8-15)17-10-11-18(28-17)20(25)24-22-23-16-9-4-13(2)12-19(16)29-22/h4-12H,3H2,1-2H3,(H,23,24,25)