N-[4-[bis(azanyl)methylidenecarbamoyl]phenoxy]-N-carbamimidoyl-3-methylsulfonyl-benzamide dihydrochloride

Systemtic Name: N-[4-[bis(azanyl)methylidenecarbamoyl]phenoxy]-N-carbamimidoyl-3-methylsulfonyl-benzamide dihydrochloride Openeye Name: N-carbamimidoyl-N-[4-(diaminomethylenecarbamoyl)phenoxy]-3-methylsulfonyl-benzamide dihydrochloride CAS Name: N-carbamimidoyl-N-[4-[(diaminomethylideneamino)-oxomethyl]phenoxy]-3-methylsulfonylbenzamide dihydrochloride IUPAC Name: N-carbamimidoyl-N-[4-(diaminomethylidenecarbamoyl)phenoxy]-3-methylsulfonylbenzamide dihydrochloride Traditional Name: N-amidino-N-[4-(diaminomethylenecarbamoyl)phenoxy]-3-mesyl-benzamide dihydrochloride Formula: C17H20Cl2N6O5S MolecularWeight: 491.3489

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N(C(=N)N)OC2=CC=C(C=C2)C(=O)N=C(N)N.Cl.Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N(C(=N)N)OC2=CC=C(C=C2)C(=O)N=C(N)N.Cl.Cl

InChI

InChI=1S/C17H18N6O5S.2ClH/c1-29(26,27)13-4-2-3-11(9-13)15(25)23(17(20)21)28-12-7-5-10(6-8-12)14(24)22-16(18)19;;/h2-9H,1H3,(H3,20,21)(H4,18,19,22,24);2*1H