1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-pentan-3-yl-urea

Systemtic Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-pentan-3-yl-urea Openeye Name: 1-(1-ethylpropyl)-3-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-pentan-3-ylurea IUPAC Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-pentan-3-ylurea Traditional Name: 1-(1-ethylpropyl)-3-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C19H29N3O2 MolecularWeight: 331.45246

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)NC1=CC2=C(CCN(C2)C(=O)C(C)C)C=C1

Isomeric SMILES

CCC(CC)NC(=O)NC1=CC2=C(CCN(C2)C(=O)C(C)C)C=C1

InChI

InChI=1S/C19H29N3O2/c1-5-16(6-2)20-19(24)21-17-8-7-14-9-10-22(12-15(14)11-17)18(23)13(3)4/h7-8,11,13,16H,5-6,9-10,12H2,1-4H3,(H2,20,21,24)