1-tert-butyl-3-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]urea

Systemtic Name: 1-tert-butyl-3-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]urea Openeye Name: 1-tert-butyl-3-[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]urea CAS Name: 1-tert-butyl-3-[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]urea IUPAC Name: 1-tert-butyl-3-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]urea Traditional Name: 1-tert-butyl-3-[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]urea Formula: C16H28N4OS MolecularWeight: 324.48472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NCC(C1=CSC=C1)N2CCN(CC2)C

Isomeric SMILES

CC(C)(C)NC(=O)NCC(C1=CSC=C1)N2CCN(CC2)C

InChI

InChI=1S/C16H28N4OS/c1-16(2,3)18-15(21)17-11-14(13-5-10-22-12-13)20-8-6-19(4)7-9-20/h5,10,12,14H,6-9,11H2,1-4H3,(H2,17,18,21)