N-butan-2-yl-5-[(3-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide

Systemtic Name: N-butan-2-yl-5-[(3-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: 5-[(3-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-5-[[(3-cyanoanilino)-oxomethyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: N-butan-2-yl-5-[(3-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: 5-[(3-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazino]-N-sec-butyl-benzamide Formula: C30H34N6O3 MolecularWeight: 526.62936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC(=C2)C#N)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC(=C2)C#N)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C30H34N6O3/c1-4-21(2)32-29(37)25-19-24(34-30(38)33-23-9-7-8-22(18-23)20-31)12-13-26(25)35-14-16-36(17-15-35)27-10-5-6-11-28(27)39-3/h5-13,18-19,21H,4,14-17H2,1-3H3,(H,32,37)(H2,33,34,38)