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

Systemtic Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(thiophen-2-ylmethyl)urea Openeye Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(2-thienylmethyl)urea CAS Name: 1-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(thiophen-2-ylmethyl)urea IUPAC Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(thiophen-2-ylmethyl)urea Traditional Name: 1-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(2-thenyl)urea Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=CS3

Isomeric SMILES

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=CS3

InChI

InChI=1S/C19H23N3O2S/c1-13(2)18(23)22-8-7-14-5-6-16(10-15(14)12-22)21-19(24)20-11-17-4-3-9-25-17/h3-6,9-10,13H,7-8,11-12H2,1-2H3,(H2,20,21,24)