3-phenyl-1-(phenylcarbamothioyl)-1-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]thiourea

Systemtic Name: 3-phenyl-1-(phenylcarbamothioyl)-1-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]thiourea Openeye Name: 3-phenyl-1-(phenylcarbamothioyl)-1-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]thiourea CAS Name: 1-[anilino(sulfanylidene)methyl]-3-phenyl-1-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]thiourea IUPAC Name: 3-phenyl-1-(phenylcarbamothioyl)-1-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]thiourea Traditional Name: 3-phenyl-1-(phenylthiocarbamoyl)-1-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]thiourea Formula: C24H25N4S2+ MolecularWeight: 433.6121

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]C(C2=CC=CC=C21)CN(C(=S)NC3=CC=CC=C3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

C1C[NH2+][C@H](C2=CC=CC=C21)CN(C(=S)NC3=CC=CC=C3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C24H24N4S2/c29-23(26-19-10-3-1-4-11-19)28(24(30)27-20-12-5-2-6-13-20)17-22-21-14-8-7-9-18(21)15-16-25-22/h1-14,22,25H,15-17H2,(H,26,29)(H,27,30)/p+1/t22-/m0/s1