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

Systemtic Name: 5-[(3-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-5-[(3-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide CAS Name: 5-[[(3-cyanoanilino)-oxomethyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-5-[(3-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: N-benzyl-5-[(3-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C33H32N6O3 MolecularWeight: 560.64558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)NC4=CC=CC(=C4)C#N)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)NC4=CC=CC(=C4)C#N)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C33H32N6O3/c1-42-31-13-6-5-12-30(31)39-18-16-38(17-19-39)29-15-14-27(37-33(41)36-26-11-7-10-25(20-26)22-34)21-28(29)32(40)35-23-24-8-3-2-4-9-24/h2-15,20-21H,16-19,23H2,1H3,(H,35,40)(H2,36,37,41)