N-butyl-N-(1H-imidazol-5-ylmethyl)-4-(phenylsulfinyl)aniline

Systemtic Name: N-butyl-N-(1H-imidazol-5-ylmethyl)-4-(phenylsulfinyl)aniline Openeye Name: 4-(benzenesulfinyl)-N-butyl-N-(1H-imidazol-5-ylmethyl)aniline CAS Name: 4-(benzenesulfinyl)-N-butyl-N-(1H-imidazol-5-ylmethyl)aniline IUPAC Name: 4-(benzenesulfinyl)-N-butyl-N-(1H-imidazol-5-ylmethyl)aniline Traditional Name: [4-(benzenesulfinyl)phenyl]-butyl-(1H-imidazol-5-ylmethyl)amine Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CN=CN1)C2=CC=C(C=C2)S(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCN(CC1=CN=CN1)C2=CC=C(C=C2)S(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23N3OS/c1-2-3-13-23(15-17-14-21-16-22-17)18-9-11-20(12-10-18)25(24)19-7-5-4-6-8-19/h4-12,14,16H,2-3,13,15H2,1H3,(H,21,22)