N-(3-imidazol-1-ylpropyl)-2-(3-methylphenyl)-4-(phenylsulfonyl)-1,3-oxazol-5-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-2-(3-methylphenyl)-4-(phenylsulfonyl)-1,3-oxazol-5-amine Openeye Name: 4-(benzenesulfonyl)-N-(3-imidazol-1-ylpropyl)-2-(m-tolyl)oxazol-5-amine CAS Name: 4-(benzenesulfonyl)-N-[3-(1-imidazolyl)propyl]-2-(3-methylphenyl)-5-oxazolamine IUPAC Name: 4-(benzenesulfonyl)-N-(3-imidazol-1-ylpropyl)-2-(3-methylphenyl)-1,3-oxazol-5-amine Traditional Name: [4-besyl-2-(m-tolyl)oxazol-5-yl]-(3-imidazol-1-ylpropyl)amine Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(O2)NCCCN3C=CN=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(O2)NCCCN3C=CN=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O3S/c1-17-7-5-8-18(15-17)20-25-22(30(27,28)19-9-3-2-4-10-19)21(29-20)24-11-6-13-26-14-12-23-16-26/h2-5,7-10,12,14-16,24H,6,11,13H2,1H3