4-tert-butyl-N-[2-methyl-3-[4-methyl-6-[[4-(4-methylpiperazin-1-yl)carbonylphenyl]amino]-5-oxidanylidene-pyrazin-2-yl]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-methyl-3-[4-methyl-6-[[4-(4-methylpiperazin-1-yl)carbonylphenyl]amino]-5-oxidanylidene-pyrazin-2-yl]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[2-methyl-3-[4-methyl-6-[4-(4-methylpiperazine-1-carbonyl)anilino]-5-oxo-pyrazin-2-yl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[2-methyl-3-[4-methyl-6-[4-[(4-methyl-1-piperazinyl)-oxomethyl]anilino]-5-oxo-2-pyrazinyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-methyl-3-[4-methyl-6-[4-(4-methylpiperazine-1-carbonyl)anilino]-5-oxopyrazin-2-yl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[5-keto-4-methyl-6-[4-(4-methylpiperazine-1-carbonyl)anilino]pyrazin-2-yl]-2-methyl-phenyl]benzamide Formula: C35H40N6O3 MolecularWeight: 592.7305

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CN(C(=O)C(=N3)NC4=CC=C(C=C4)C(=O)N5CCN(CC5)C)C

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CN(C(=O)C(=N3)NC4=CC=C(C=C4)C(=O)N5CCN(CC5)C)C

InChI

InChI=1S/C35H40N6O3/c1-23-28(8-7-9-29(23)38-32(42)24-10-14-26(15-11-24)35(2,3)4)30-22-40(6)34(44)31(37-30)36-27-16-12-25(13-17-27)33(43)41-20-18-39(5)19-21-41/h7-17,22H,18-21H2,1-6H3,(H,36,37)(H,38,42)