1-cyclohexyl-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]urea

Systemtic Name: 1-cyclohexyl-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]urea Openeye Name: 1-cyclohexyl-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]thiazol-2-yl]urea CAS Name: 1-cyclohexyl-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-thiazolyl]urea IUPAC Name: 1-cyclohexyl-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1,3-thiazol-2-yl]urea Traditional Name: 1-cyclohexyl-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thiazol-2-yl]urea Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=NC(=CS2)CC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=NC(=CS2)CC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H26N4O2S/c26-19(25-11-10-15-6-4-5-7-16(15)13-25)12-18-14-28-21(23-18)24-20(27)22-17-8-2-1-3-9-17/h4-7,14,17H,1-3,8-13H2,(H2,22,23,24,27)