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

Systemtic Name: methyl 5-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[1-(1,3-benzothiazol-2-yl)ethyl-methylamino]-oxomethyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[1-(1,3-benzothiazol-2-yl)ethyl-methylcarbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)N(C)C(C)C2=NC3=CC=CC=C3S2)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)N(C)C(C)C2=NC3=CC=CC=C3S2)C)C(=O)OC

InChI

InChI=1S/C20H23N3O3S/c1-6-13-16(20(25)26-5)11(2)17(21-13)19(24)23(4)12(3)18-22-14-9-7-8-10-15(14)27-18/h7-10,12,21H,6H2,1-5H3