3-(6-oxidanyl-3,4-dihydro-2H-chromen-3-yl)-4-[2-[(phenylmethyl)amino]ethyl]-1H-imidazole-2-thione

Systemtic Name: 3-(6-oxidanyl-3,4-dihydro-2H-chromen-3-yl)-4-[2-[(phenylmethyl)amino]ethyl]-1H-imidazole-2-thione Openeye Name: 4-[2-(benzylamino)ethyl]-3-(6-hydroxychroman-3-yl)-1H-imidazole-2-thione CAS Name: 3-(6-hydroxy-3,4-dihydro-2H-1-benzopyran-3-yl)-4-[2-[(phenylmethyl)amino]ethyl]-1H-imidazole-2-thione IUPAC Name: 4-[2-(benzylamino)ethyl]-3-(6-hydroxy-3,4-dihydro-2H-chromen-3-yl)-1H-imidazole-2-thione Traditional Name: 5-[2-(benzylamino)ethyl]-1-(6-hydroxychroman-3-yl)-4-imidazoline-2-thione Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=C(C=C2)O)N3C(=CNC3=S)CCNCC4=CC=CC=C4

Isomeric SMILES

C1C(COC2=C1C=C(C=C2)O)N3C(=CNC3=S)CCNCC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2S/c25-19-6-7-20-16(11-19)10-18(14-26-20)24-17(13-23-21(24)27)8-9-22-12-15-4-2-1-3-5-15/h1-7,11,13,18,22,25H,8-10,12,14H2,(H,23,27)