6-[[4-(4-morpholin-4-ylcarbonylpiperazin-1-yl)phenyl]amino]-4-[(phenylmethyl)amino]pyridine-3-carboxamide

Systemtic Name: 6-[[4-(4-morpholin-4-ylcarbonylpiperazin-1-yl)phenyl]amino]-4-[(phenylmethyl)amino]pyridine-3-carboxamide Openeye Name: 4-(benzylamino)-6-[4-[4-(morpholine-4-carbonyl)piperazin-1-yl]anilino]pyridine-3-carboxamide CAS Name: 6-[4-[4-[4-morpholinyl(oxo)methyl]-1-piperazinyl]anilino]-4-[(phenylmethyl)amino]-3-pyridinecarboxamide IUPAC Name: 4-(benzylamino)-6-[4-[4-(morpholine-4-carbonyl)piperazin-1-yl]anilino]pyridine-3-carboxamide Traditional Name: 4-(benzylamino)-6-[4-[4-(morpholine-4-carbonyl)piperazino]anilino]nicotinamide Formula: C28H33N7O3 MolecularWeight: 515.60672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC3=NC=C(C(=C3)NCC4=CC=CC=C4)C(=O)N)C(=O)N5CCOCC5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC3=NC=C(C(=C3)NCC4=CC=CC=C4)C(=O)N)C(=O)N5CCOCC5

InChI

InChI=1S/C28H33N7O3/c29-27(36)24-20-31-26(18-25(24)30-19-21-4-2-1-3-5-21)32-22-6-8-23(9-7-22)33-10-12-34(13-11-33)28(37)35-14-16-38-17-15-35/h1-9,18,20H,10-17,19H2,(H2,29,36)(H2,30,31,32)