3-[6,8-bis(chloranyl)-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]-1-ethyl-1-(phenylsulfonyl)urea

Systemtic Name: 3-[6,8-bis(chloranyl)-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]-1-ethyl-1-(phenylsulfonyl)urea Openeye Name: 1-(benzenesulfonyl)-3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)-1-ethyl-urea CAS Name: 1-(benzenesulfonyl)-3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)-1-ethylurea IUPAC Name: 1-(benzenesulfonyl)-3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)-1-ethylurea Traditional Name: 1-besyl-3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)-1-ethyl-urea Formula: C19H21Cl2N3O3S MolecularWeight: 442.35934

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)NC1CN(CC2=C(C=C(C=C12)Cl)Cl)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN(C(=O)NC1CN(CC2=C(C=C(C=C12)Cl)Cl)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21Cl2N3O3S/c1-3-24(28(26,27)14-7-5-4-6-8-14)19(25)22-18-12-23(2)11-16-15(18)9-13(20)10-17(16)21/h4-10,18H,3,11-12H2,1-2H3,(H,22,25)