N-butan-2-yl-5-[(2,6-dimethylphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide

Systemtic Name: N-butan-2-yl-5-[(2,6-dimethylphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: 5-[(2,6-dimethylphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-5-[[(2,6-dimethylanilino)-oxomethyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: N-butan-2-yl-5-[(2,6-dimethylphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: 5-[(2,6-dimethylphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazino]-N-sec-butyl-benzamide Formula: C31H39N5O3 MolecularWeight: 529.67306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=C(C=CC=C2C)C)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=C(C=CC=C2C)C)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C31H39N5O3/c1-6-23(4)32-30(37)25-20-24(33-31(38)34-29-21(2)10-9-11-22(29)3)14-15-26(25)35-16-18-36(19-17-35)27-12-7-8-13-28(27)39-5/h7-15,20,23H,6,16-19H2,1-5H3,(H,32,37)(H2,33,34,38)