N-[(4-butoxy-3-methoxy-phenyl)methyl]-4-(2-methyl-1,3-thiazol-4-yl)-1H-pyrrole-2-carboxamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-4-(2-methyl-1,3-thiazol-4-yl)-1H-pyrrole-2-carboxamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-4-(2-methylthiazol-4-yl)-1H-pyrrole-2-carboxamide CAS Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-4-(2-methyl-4-thiazolyl)-1H-pyrrole-2-carboxamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-4-(2-methyl-1,3-thiazol-4-yl)-1H-pyrrole-2-carboxamide Traditional Name: N-(4-butoxy-3-methoxy-benzyl)-4-(2-methylthiazol-4-yl)-1H-pyrrole-2-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CN2)C3=CSC(=N3)C)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CN2)C3=CSC(=N3)C)OC

InChI

InChI=1S/C21H25N3O3S/c1-4-5-8-27-19-7-6-15(9-20(19)26-3)11-23-21(25)17-10-16(12-22-17)18-13-28-14(2)24-18/h6-7,9-10,12-13,22H,4-5,8,11H2,1-3H3,(H,23,25)