N-(2-diethylaminoethyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]-2-piperidin-1-yl-benzamide

Systemtic Name: N-(2-diethylaminoethyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]-2-piperidin-1-yl-benzamide Openeye Name: N-(2-diethylaminoethyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]-2-(1-piperidyl)benzamide CAS Name: N-(2-diethylaminoethyl)-5-[[[4-(methylthio)anilino]-oxomethyl]amino]-2-(1-piperidinyl)benzamide IUPAC Name: N-(2-diethylaminoethyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]-2-piperidin-1-ylbenzamide Traditional Name: N-(2-diethylaminoethyl)-5-[[4-(methylthio)phenyl]carbamoylamino]-2-piperidino-benzamide Formula: C26H37N5O2S MolecularWeight: 483.66928

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)SC)N3CCCCC3

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)SC)N3CCCCC3

InChI

InChI=1S/C26H37N5O2S/c1-4-30(5-2)18-15-27-25(32)23-19-21(11-14-24(23)31-16-7-6-8-17-31)29-26(33)28-20-9-12-22(34-3)13-10-20/h9-14,19H,4-8,15-18H2,1-3H3,(H,27,32)(H2,28,29,33)