3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[3-(4-benzylpiperazin-1-yl)propyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[3-(4-benzylpiperazin-1-yl)propyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[3-(4-benzylpiperazino)propyl]propionamide Formula: C19H30N4O2S MolecularWeight: 378.5321

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)CCSCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CCCNC(=O)CCSCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C19H30N4O2S/c20-18(24)16-26-14-7-19(25)21-8-4-9-22-10-12-23(13-11-22)15-17-5-2-1-3-6-17/h1-3,5-6H,4,7-16H2,(H2,20,24)(H,21,25)