[2-[[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]carbamoyl]phenyl] ethanoate

Systemtic Name: [2-[[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]carbamoyl]phenyl] ethanoate Openeye Name: [2-[[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]carbamoyl]phenyl] acetate CAS Name: acetic acid [2-[[[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]amino]-oxomethyl]phenyl] ester IUPAC Name: [2-[[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]carbamoyl]phenyl] acetate Traditional Name: acetic acid [2-[[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]carbamoyl]phenyl] ester Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

InChI

InChI=1S/C20H25N3O3S/c1-15(24)26-19-6-4-3-5-17(19)20(25)21-13-18(16-7-12-27-14-16)23-10-8-22(2)9-11-23/h3-7,12,14,18H,8-11,13H2,1-2H3,(H,21,25)