5-[(4-methylsulfanylphenyl)carbamoylamino]-N-(phenylmethyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(4-methylsulfanylphenyl)carbamoylamino]-N-(phenylmethyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: N-benzyl-5-[(4-methylsulfanylphenyl)carbamoylamino]-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[[4-(methylthio)anilino]-oxomethyl]amino]-N-(phenylmethyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-benzyl-5-[(4-methylsulfanylphenyl)carbamoylamino]-2-pyrrolidin-1-ylbenzamide Traditional Name: N-benzyl-5-[[4-(methylthio)phenyl]carbamoylamino]-2-pyrrolidino-benzamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H28N4O2S/c1-33-22-12-9-20(10-13-22)28-26(32)29-21-11-14-24(30-15-5-6-16-30)23(17-21)25(31)27-18-19-7-3-2-4-8-19/h2-4,7-14,17H,5-6,15-16,18H2,1H3,(H,27,31)(H2,28,29,32)