N-butan-2-yl-5-[(2-ethoxyphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide

Systemtic Name: N-butan-2-yl-5-[(2-ethoxyphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: 5-[(2-ethoxyphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-5-[[(2-ethoxyanilino)-oxomethyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: N-butan-2-yl-5-[(2-ethoxyphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: 2-[4-(2-methoxyphenyl)piperazino]-5-(o-phenetylcarbamoylamino)-N-sec-butyl-benzamide Formula: C31H39N5O4 MolecularWeight: 545.67246

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC=C2OCC)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC=C2OCC)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C31H39N5O4/c1-5-22(3)32-30(37)24-21-23(33-31(38)34-25-11-7-9-13-28(25)40-6-2)15-16-26(24)35-17-19-36(20-18-35)27-12-8-10-14-29(27)39-4/h7-16,21-22H,5-6,17-20H2,1-4H3,(H,32,37)(H2,33,34,38)