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

Systemtic Name: 1-cyclopropyl-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Openeye Name: 1-cyclopropyl-3-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-cyclopropyl-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-cyclopropyl-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-cyclopropyl-3-(2-tosyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C20H23N3O3S MolecularWeight: 385.47992

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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)NC4CC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NC4CC4

InChI

InChI=1S/C20H23N3O3S/c1-14-2-8-19(9-3-14)27(25,26)23-11-10-15-4-5-18(12-16(15)13-23)22-20(24)21-17-6-7-17/h2-5,8-9,12,17H,6-7,10-11,13H2,1H3,(H2,21,22,24)