methyl 5-[2-[(6-methoxy-6-oxidanylidene-hexyl)amino]-1,3-thiazol-4-yl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-[(6-methoxy-6-oxidanylidene-hexyl)amino]-1,3-thiazol-4-yl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-[(6-methoxy-6-oxo-hexyl)amino]thiazol-4-yl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[(6-methoxy-6-oxohexyl)amino]-4-thiazolyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[(6-methoxy-6-oxohexyl)amino]-1,3-thiazol-4-yl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[(6-keto-6-methoxy-hexyl)amino]thiazol-4-yl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C2=CSC(=N2)NCCCCCC(=O)OC

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C2=CSC(=N2)NCCCCCC(=O)OC

InChI

InChI=1S/C18H25N3O4S/c1-11-15(17(23)25-4)12(2)20-16(11)13-10-26-18(21-13)19-9-7-5-6-8-14(22)24-3/h10,20H,5-9H2,1-4H3,(H,19,21)