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

Systemtic Name: 5-[(4-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propyl-benzamide Openeye Name: 5-[(4-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propyl-benzamide CAS Name: 5-[[(4-cyanoanilino)-oxomethyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-propylbenzamide IUPAC Name: 5-[(4-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propylbenzamide Traditional Name: 5-[(4-cyanophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazino]-N-propyl-benzamide Formula: C29H32N6O3 MolecularWeight: 512.60278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H32N6O3/c1-3-14-31-28(36)24-19-23(33-29(37)32-22-10-8-21(20-30)9-11-22)12-13-25(24)34-15-17-35(18-16-34)26-6-4-5-7-27(26)38-2/h4-13,19H,3,14-18H2,1-2H3,(H,31,36)(H2,32,33,37)