3-azanyl-6-chloranyl-N-(diazanylmethylidene)-5-[4-(6,7-dimethoxy-4-piperazin-1-yl-quinazolin-2-yl)piperazin-1-yl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-6-chloranyl-N-(diazanylmethylidene)-5-[4-(6,7-dimethoxy-4-piperazin-1-yl-quinazolin-2-yl)piperazin-1-yl]pyrazine-2-carboxamide Openeye Name: 3-amino-6-chloro-5-[4-(6,7-dimethoxy-4-piperazin-1-yl-quinazolin-2-yl)piperazin-1-yl]-N-(hydrazinomethylene)pyrazine-2-carboxamide CAS Name: 3-amino-6-chloro-5-[4-[6,7-dimethoxy-4-(1-piperazinyl)-2-quinazolinyl]-1-piperazinyl]-N-(hydrazinylmethylidene)-2-pyrazinecarboxamide IUPAC Name: 3-amino-6-chloro-5-[4-(6,7-dimethoxy-4-piperazin-1-ylquinazolin-2-yl)piperazin-1-yl]-N-(hydrazinylmethylidene)pyrazine-2-carboxamide Traditional Name: 3-amino-6-chloro-5-[4-(6,7-dimethoxy-4-piperazino-quinazolin-2-yl)piperazino]-N-(hydrazinomethylene)pyrazinamide Formula: C24H31ClN12O3 MolecularWeight: 571.03454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C4=NC(=C(N=C4Cl)C(=O)N=CNN)N)N5CCNCC5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C4=NC(=C(N=C4Cl)C(=O)N=CNN)N)N5CCNCC5)OC

InChI

InChI=1S/C24H31ClN12O3/c1-39-16-11-14-15(12-17(16)40-2)31-24(34-21(14)35-5-3-28-4-6-35)37-9-7-36(8-10-37)22-19(25)32-18(20(26)33-22)23(38)29-13-30-27/h11-13,28H,3-10,27H2,1-2H3,(H2,26,33)(H,29,30,38)