1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoranyl-phenyl]thiourea

Systemtic Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoranyl-phenyl]thiourea Openeye Name: [4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoro-phenyl]thiourea CAS Name: [4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluorophenyl]thiourea IUPAC Name: [4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluorophenyl]thiourea Traditional Name: [4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoro-phenyl]thiourea Formula: C16H16FN3S MolecularWeight: 301.381743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=S)N)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=S)N)F

InChI

InChI=1S/C16H16FN3S/c17-14-9-13(19-16(18)21)5-6-15(14)20-8-7-11-3-1-2-4-12(11)10-20/h1-6,9H,7-8,10H2,(H3,18,19,21)