1-[3-(2-chlorophenyl)-5-methyl-1-benzothiophen-2-yl]-3-(2,6-diethylphenyl)urea

Systemtic Name: 1-[3-(2-chlorophenyl)-5-methyl-1-benzothiophen-2-yl]-3-(2,6-diethylphenyl)urea Openeye Name: 1-[3-(2-chlorophenyl)-5-methyl-benzothiophen-2-yl]-3-(2,6-diethylphenyl)urea CAS Name: 1-[3-(2-chlorophenyl)-5-methyl-1-benzothiophen-2-yl]-3-(2,6-diethylphenyl)urea IUPAC Name: 1-[3-(2-chlorophenyl)-5-methyl-1-benzothiophen-2-yl]-3-(2,6-diethylphenyl)urea Traditional Name: 1-[3-(2-chlorophenyl)-5-methyl-benzothiophen-2-yl]-3-(2,6-diethylphenyl)urea Formula: C26H25ClN2OS MolecularWeight: 449.0075

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)NC2=C(C3=C(S2)C=CC(=C3)C)C4=CC=CC=C4Cl

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)NC2=C(C3=C(S2)C=CC(=C3)C)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H25ClN2OS/c1-4-17-9-8-10-18(5-2)24(17)28-26(30)29-25-23(19-11-6-7-12-21(19)27)20-15-16(3)13-14-22(20)31-25/h6-15H,4-5H2,1-3H3,(H2,28,29,30)