1-(1-isoquinolin-1-ylethylamino)-3-(phenylmethyl)thiourea

Systemtic Name: 1-(1-isoquinolin-1-ylethylamino)-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[1-(1-isoquinolyl)ethylamino]thiourea CAS Name: 1-[1-(1-isoquinolinyl)ethylamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(1-isoquinolin-1-ylethylamino)thiourea Traditional Name: 1-benzyl-3-[1-(1-isoquinolyl)ethylamino]thiourea Formula: C19H20N4S MolecularWeight: 336.4539

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=CC2=CC=CC=C21)NNC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CC(C1=NC=CC2=CC=CC=C21)NNC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C19H20N4S/c1-14(18-17-10-6-5-9-16(17)11-12-20-18)22-23-19(24)21-13-15-7-3-2-4-8-15/h2-12,14,22H,13H2,1H3,(H2,21,23,24)