N-(2-azanylethyl)-4-[4-(diphenylmethyl)piperazin-1-yl]-3-(phenylcarbamoylamino)benzamide

Systemtic Name: N-(2-azanylethyl)-4-[4-(diphenylmethyl)piperazin-1-yl]-3-(phenylcarbamoylamino)benzamide Openeye Name: N-(2-aminoethyl)-4-(4-benzhydrylpiperazin-1-yl)-3-(phenylcarbamoylamino)benzamide CAS Name: N-(2-aminoethyl)-3-[[anilino(oxo)methyl]amino]-4-[4-(diphenylmethyl)-1-piperazinyl]benzamide IUPAC Name: N-(2-aminoethyl)-4-(4-benzhydrylpiperazin-1-yl)-3-(phenylcarbamoylamino)benzamide Traditional Name: N-(2-aminoethyl)-4-(4-benzhydrylpiperazino)-3-(phenylcarbamoylamino)benzamide Formula: C33H36N6O2 MolecularWeight: 548.67794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)NCCN)NC(=O)NC3=CC=CC=C3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)NCCN)NC(=O)NC3=CC=CC=C3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H36N6O2/c34-18-19-35-32(40)27-16-17-30(29(24-27)37-33(41)36-28-14-8-3-9-15-28)38-20-22-39(23-21-38)31(25-10-4-1-5-11-25)26-12-6-2-7-13-26/h1-17,24,31H,18-23,34H2,(H,35,40)(H2,36,37,41)