ethyl N-[[2-[ethanoyl-(4-methylpiperazin-1-yl)amino]phenyl]carbamothioyl]carbamate

Systemtic Name: ethyl N-[[2-[ethanoyl-(4-methylpiperazin-1-yl)amino]phenyl]carbamothioyl]carbamate Openeye Name: ethyl N-[[2-[acetyl-(4-methylpiperazin-1-yl)amino]phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[acetyl-(4-methyl-1-piperazinyl)amino]anilino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[2-[acetyl-(4-methylpiperazin-1-yl)amino]phenyl]carbamothioyl]carbamate Traditional Name: N-[[2-[acetyl-(4-methylpiperazino)amino]phenyl]thiocarbamoyl]carbamic acid ethyl ester Formula: C17H25N5O3S MolecularWeight: 379.4771

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NC1=CC=CC=C1N(C(=O)C)N2CCN(CC2)C

Isomeric SMILES

CCOC(=O)NC(=S)NC1=CC=CC=C1N(C(=O)C)N2CCN(CC2)C

InChI

InChI=1S/C17H25N5O3S/c1-4-25-17(24)19-16(26)18-14-7-5-6-8-15(14)22(13(2)23)21-11-9-20(3)10-12-21/h5-8H,4,9-12H2,1-3H3,(H2,18,19,24,26)