2-chloranyl-5-[(4-methoxyphenyl)carbonylamino]-N-[2-[(4-piperidin-4-ylsulfonylphenyl)amino]pyrimidin-5-yl]benzamide

Systemtic Name: 2-chloranyl-5-[(4-methoxyphenyl)carbonylamino]-N-[2-[(4-piperidin-4-ylsulfonylphenyl)amino]pyrimidin-5-yl]benzamide Openeye Name: 2-chloro-5-[(4-methoxybenzoyl)amino]-N-[2-[4-(4-piperidylsulfonyl)anilino]pyrimidin-5-yl]benzamide CAS Name: 2-chloro-5-[[(4-methoxyphenyl)-oxomethyl]amino]-N-[2-[4-(4-piperidinylsulfonyl)anilino]-5-pyrimidinyl]benzamide IUPAC Name: 2-chloro-5-[(4-methoxybenzoyl)amino]-N-[2-(4-piperidin-4-ylsulfonylanilino)pyrimidin-5-yl]benzamide Traditional Name: 2-chloro-5-(p-anisoylamino)-N-[2-[4-(4-piperidylsulfonyl)anilino]pyrimidin-5-yl]benzamide Formula: C30H29ClN6O5S MolecularWeight: 621.10646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)C(=O)NC3=CN=C(N=C3)NC4=CC=C(C=C4)S(=O)(=O)C5CCNCC5

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)C(=O)NC3=CN=C(N=C3)NC4=CC=C(C=C4)S(=O)(=O)C5CCNCC5

InChI

InChI=1S/C30H29ClN6O5S/c1-42-23-7-2-19(3-8-23)28(38)35-21-6-11-27(31)26(16-21)29(39)36-22-17-33-30(34-18-22)37-20-4-9-24(10-5-20)43(40,41)25-12-14-32-15-13-25/h2-11,16-18,25,32H,12-15H2,1H3,(H,35,38)(H,36,39)(H,33,34,37)