5-(butylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzamide

Systemtic Name: 5-(butylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzamide Openeye Name: 5-(butylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzamide CAS Name: 5-[[butylamino(oxo)methyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-(1-phenylethyl)benzamide IUPAC Name: 5-(butylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)benzamide Traditional Name: 5-(butylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazino]-N-(1-phenylethyl)benzamide Formula: C31H39N5O3 MolecularWeight: 529.67306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NC(C)C4=CC=CC=C4

Isomeric SMILES

CCCCNC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C31H39N5O3/c1-4-5-17-32-31(38)34-25-15-16-27(26(22-25)30(37)33-23(2)24-11-7-6-8-12-24)35-18-20-36(21-19-35)28-13-9-10-14-29(28)39-3/h6-16,22-23H,4-5,17-21H2,1-3H3,(H,33,37)(H2,32,34,38)