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

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(4-methylsulfanylphenyl)carbamoylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[[[4-(methylthio)anilino]-oxomethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide Traditional Name: N-benzyl-2-[4-(2-methoxyphenyl)piperazino]-5-[[4-(methylthio)phenyl]carbamoylamino]benzamide Formula: C33H35N5O3S MolecularWeight: 581.7277

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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=C(C=C4)SC)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C33H35N5O3S/c1-41-31-11-7-6-10-30(31)38-20-18-37(19-21-38)29-17-14-26(36-33(40)35-25-12-15-27(42-2)16-13-25)22-28(29)32(39)34-23-24-8-4-3-5-9-24/h3-17,22H,18-21,23H2,1-2H3,(H,34,39)(H2,35,36,40)