3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[2-methyl-4-(4-methylpiperazino)phenyl]propionamide Formula: C17H26N4O2S MolecularWeight: 350.47894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)CCSCC(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)CCSCC(=O)N

InChI

InChI=1S/C17H26N4O2S/c1-13-11-14(21-8-6-20(2)7-9-21)3-4-15(13)19-17(23)5-10-24-12-16(18)22/h3-4,11H,5-10,12H2,1-2H3,(H2,18,22)(H,19,23)