2-[4-(4-chlorophenyl)-2-phenyl-1,3-thiazol-5-yl]ethanoic acid; diphenyltin

Systemtic Name: 2-[4-(4-chlorophenyl)-2-phenyl-1,3-thiazol-5-yl]ethanoic acid; diphenyltin Openeye Name: 2-[4-(4-chlorophenyl)-2-phenyl-thiazol-5-yl]acetic acid; diphenyltin CAS Name: 2-[4-(4-chlorophenyl)-2-phenyl-5-thiazolyl]acetic acid; diphenyltin IUPAC Name: 2-[4-(4-chlorophenyl)-2-phenyl-1,3-thiazol-5-yl]acetic acid; diphenyltin Traditional Name: 2-[4-(4-chlorophenyl)-2-phenyl-thiazol-5-yl]acetic acid; diphenyltin Formula: C46H34Cl2N2O4S2Sn MolecularWeight: 932.51916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(S2)CC(=O)O)C3=CC=C(C=C3)Cl.C1=CC=C(C=C1)C2=NC(=C(S2)CC(=O)O)C3=CC=C(C=C3)Cl.C1=CC=C(C=C1)[Sn]C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(S2)CC(=O)O)C3=CC=C(C=C3)Cl.C1=CC=C(C=C1)C2=NC(=C(S2)CC(=O)O)C3=CC=C(C=C3)Cl.C1=CC=C(C=C1)[Sn]C2=CC=CC=C2

InChI

InChI=1S/2C17H12ClNO2S.2C6H5.Sn/c2*18-13-8-6-11(7-9-13)16-14(10-15(20)21)22-17(19-16)12-4-2-1-3-5-12;2*1-2-4-6-5-3-1;/h2*1-9H,10H2,(H,20,21);2*1-5H;