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

Systemtic Name: N-cyclopropyl-5-[(4-methylsulfanylphenyl)carbamoylamino]-2-pyrrolidin-1-yl-benzamide Openeye Name: N-cyclopropyl-5-[(4-methylsulfanylphenyl)carbamoylamino]-2-pyrrolidin-1-yl-benzamide CAS Name: N-cyclopropyl-5-[[[4-(methylthio)anilino]-oxomethyl]amino]-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-cyclopropyl-5-[(4-methylsulfanylphenyl)carbamoylamino]-2-pyrrolidin-1-ylbenzamide Traditional Name: N-cyclopropyl-5-[[4-(methylthio)phenyl]carbamoylamino]-2-pyrrolidino-benzamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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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)NC4CC4

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NC4CC4

InChI

InChI=1S/C22H26N4O2S/c1-29-18-9-6-16(7-10-18)24-22(28)25-17-8-11-20(26-12-2-3-13-26)19(14-17)21(27)23-15-4-5-15/h6-11,14-15H,2-5,12-13H2,1H3,(H,23,27)(H2,24,25,28)