3,5-bis(azanyl)-N-[N'-[4-[4-[1-[bis(azanyl)methylideneamino]ethylcarbamoyl]phenyl]butyl]carbamimidoyl]-6-chloranyl-pyrazine-2-carboxamide hydrochloride

Systemtic Name: 3,5-bis(azanyl)-N-[N'-[4-[4-[1-[bis(azanyl)methylideneamino]ethylcarbamoyl]phenyl]butyl]carbamimidoyl]-6-chloranyl-pyrazine-2-carboxamide hydrochloride Openeye Name: 3,5-diamino-6-chloro-N-[N'-[4-[4-(1-guanidinoethylcarbamoyl)phenyl]butyl]carbamimidoyl]pyrazine-2-carboxamide hydrochloride CAS Name: 3,5-diamino-N-[amino-[4-[4-[[1-(diaminomethylideneamino)ethylamino]-oxomethyl]phenyl]butylimino]methyl]-6-chloro-2-pyrazinecarboxamide hydrochloride IUPAC Name: 3,5-diamino-6-chloro-N-[N'-[4-[4-[1-(diaminomethylideneamino)ethylcarbamoyl]phenyl]butyl]carbamimidoyl]pyrazine-2-carboxamide hydrochloride Traditional Name: 3,5-diamino-6-chloro-N-[N'-[4-[4-(1-guanidinoethylcarbamoyl)phenyl]butyl]amidino]pyrazinamide hydrochloride Formula: C20H29Cl2N11O2 MolecularWeight: 526.42276

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)C1=CC=C(C=C1)CCCCN=C(N)NC(=O)C2=C(N=C(C(=N2)Cl)N)N)N=C(N)N.Cl

Isomeric SMILES

CC(NC(=O)C1=CC=C(C=C1)CCCCN=C(N)NC(=O)C2=C(N=C(C(=N2)Cl)N)N)N=C(N)N.Cl

InChI

InChI=1S/C20H28ClN11O2.ClH/c1-10(29-19(24)25)28-17(33)12-7-5-11(6-8-12)4-2-3-9-27-20(26)32-18(34)13-15(22)31-16(23)14(21)30-13;/h5-8,10H,2-4,9H2,1H3,(H,28,33)(H4,22,23,31)(H4,24,25,29)(H3,26,27,32,34);1H