1-[(4-methylphenyl)methyl]-3-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-yl-ethyl]urea

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-yl-ethyl]urea Openeye Name: 1-[2-(4-methylpiperazin-1-yl)-2-(2-thienyl)ethyl]-3-(p-tolylmethyl)urea CAS Name: 1-[(4-methylphenyl)methyl]-3-[2-(4-methyl-1-piperazinyl)-2-thiophen-2-ylethyl]urea IUPAC Name: 1-[(4-methylphenyl)methyl]-3-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-ylethyl]urea Traditional Name: 1-(4-methylbenzyl)-3-[2-(4-methylpiperazino)-2-(2-thienyl)ethyl]urea Formula: C20H28N4OS MolecularWeight: 372.52752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)NCC(C2=CC=CS2)N3CCN(CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)NCC(C2=CC=CS2)N3CCN(CC3)C

InChI

InChI=1S/C20H28N4OS/c1-16-5-7-17(8-6-16)14-21-20(25)22-15-18(19-4-3-13-26-19)24-11-9-23(2)10-12-24/h3-8,13,18H,9-12,14-15H2,1-2H3,(H2,21,22,25)