1-[(4-fluorophenyl)methyl]-3-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-yl-ethyl]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-yl-ethyl]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[2-(4-methylpiperazin-1-yl)-2-(2-thienyl)ethyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[2-(4-methyl-1-piperazinyl)-2-thiophen-2-ylethyl]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-ylethyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[2-(4-methylpiperazino)-2-(2-thienyl)ethyl]thiourea Formula: C19H25FN4S2 MolecularWeight: 392.557003

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNC(=S)NCC2=CC=C(C=C2)F)C3=CC=CS3

Isomeric SMILES

CN1CCN(CC1)C(CNC(=S)NCC2=CC=C(C=C2)F)C3=CC=CS3

InChI

InChI=1S/C19H25FN4S2/c1-23-8-10-24(11-9-23)17(18-3-2-12-26-18)14-22-19(25)21-13-15-4-6-16(20)7-5-15/h2-7,12,17H,8-11,13-14H2,1H3,(H2,21,22,25)