3-(4-butylphenyl)-1-[(4-ethoxyphenyl)methyl]-1-methyl-thiourea

Systemtic Name: 3-(4-butylphenyl)-1-[(4-ethoxyphenyl)methyl]-1-methyl-thiourea Openeye Name: 3-(4-butylphenyl)-1-[(4-ethoxyphenyl)methyl]-1-methyl-thiourea CAS Name: 3-(4-butylphenyl)-1-[(4-ethoxyphenyl)methyl]-1-methylthiourea IUPAC Name: 3-(4-butylphenyl)-1-[(4-ethoxyphenyl)methyl]-1-methylthiourea Traditional Name: 3-(4-butylphenyl)-1-(4-ethoxybenzyl)-1-methyl-thiourea Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(C)CC2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(C)CC2=CC=C(C=C2)OCC

InChI

InChI=1S/C21H28N2OS/c1-4-6-7-17-8-12-19(13-9-17)22-21(25)23(3)16-18-10-14-20(15-11-18)24-5-2/h8-15H,4-7,16H2,1-3H3,(H,22,25)