methyl 5-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylcarbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylcarbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylcarbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methylamino]-oxomethyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylcarbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylcarbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3)C)C(=O)OC

InChI

InChI=1S/C22H21N3O4S/c1-4-14-18(22(27)28-3)12(2)19(24-14)20(26)23-11-13-9-10-16(29-13)21-25-15-7-5-6-8-17(15)30-21/h5-10,24H,4,11H2,1-3H3,(H,23,26)