N-[(S)-(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-[(S)-(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-thiophen-2-yl-butanamide Openeye Name: N-[(S)-(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-(2-thienyl)butanamide CAS Name: N-[(S)-(3,5-dimethoxyphenyl)-(1-methyl-2-imidazolyl)methyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[(S)-(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-thiophen-2-ylbutanamide Traditional Name: N-[(S)-(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-(2-thienyl)butyramide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC(=CC(=C2)OC)OC)NC(=O)CCCC3=CC=CS3

Isomeric SMILES

CN1C=CN=C1[C@H](C2=CC(=CC(=C2)OC)OC)NC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C21H25N3O3S/c1-24-10-9-22-21(24)20(15-12-16(26-2)14-17(13-15)27-3)23-19(25)8-4-6-18-7-5-11-28-18/h5,7,9-14,20H,4,6,8H2,1-3H3,(H,23,25)/t20-/m0/s1