N,N-diethyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(2-phenylsulfanylethanoylamino)benzamide

Systemtic Name: N,N-diethyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(2-phenylsulfanylethanoylamino)benzamide Openeye Name: N,N-diethyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(2-phenylsulfanylacetyl)amino]benzamide CAS Name: N,N-diethyl-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[[1-oxo-2-(phenylthio)ethyl]amino]benzamide IUPAC Name: N,N-diethyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(2-phenylsulfanylacetyl)amino]benzamide Traditional Name: N,N-diethyl-2-[4-(2-methoxyphenyl)piperazino]-5-[[2-(phenylthio)acetyl]amino]benzamide Formula: C30H36N4O3S MolecularWeight: 532.69684

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=CC(=C1)NC(=O)CSC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=CC(=C1)NC(=O)CSC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C30H36N4O3S/c1-4-32(5-2)30(36)25-21-23(31-29(35)22-38-24-11-7-6-8-12-24)15-16-26(25)33-17-19-34(20-18-33)27-13-9-10-14-28(27)37-3/h6-16,21H,4-5,17-20,22H2,1-3H3,(H,31,35)