1-[2-(4-methoxyphenyl)ethyl]-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea

Systemtic Name: 1-[2-(4-methoxyphenyl)ethyl]-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Openeye Name: 1-[2-(4-methoxyphenyl)ethyl]-3-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-[2-(4-methoxyphenyl)ethyl]-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-[2-(4-methoxyphenyl)ethyl]-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-[2-(4-methoxyphenyl)ethyl]-3-(2-tosyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NCCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NCCC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H29N3O4S/c1-19-3-11-25(12-4-19)34(31,32)29-16-14-21-7-8-23(17-22(21)18-29)28-26(30)27-15-13-20-5-9-24(33-2)10-6-20/h3-12,17H,13-16,18H2,1-2H3,(H2,27,28,30)