1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1C[C@@H](OC1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H25N3O3S2/c25-29(26,24-12-11-16-4-1-2-5-17(16)15-24)20-9-7-18(8-10-20)23-21(28)22-14-19-6-3-13-27-19/h1-2,4-5,7-10,19H,3,6,11-15H2,(H2,22,23,28)/t19-/m1/s1