1-[1-[bis(azanyl)methylideneamino]-4-chloranyl-isoquinolin-7-yl]sulfonyl-N-(2-dimethylaminoethyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-[1-[bis(azanyl)methylideneamino]-4-chloranyl-isoquinolin-7-yl]sulfonyl-N-(2-dimethylaminoethyl)pyrrolidine-2-carboxamide Openeye Name: 1-[(4-chloro-1-guanidino-7-isoquinolyl)sulfonyl]-N-(2-dimethylaminoethyl)pyrrolidine-2-carboxamide CAS Name: 1-[[4-chloro-1-(diaminomethylideneamino)-7-isoquinolinyl]sulfonyl]-N-(2-dimethylaminoethyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-[4-chloro-1-(diaminomethylideneamino)isoquinolin-7-yl]sulfonyl-N-(2-dimethylaminoethyl)pyrrolidine-2-carboxamide Traditional Name: 1-[(4-chloro-1-guanidino-7-isoquinolyl)sulfonyl]-N-(2-dimethylaminoethyl)pyrrolidine-2-carboxamide Formula: C19H26ClN7O3S MolecularWeight: 467.97284

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1CCCN1S(=O)(=O)C2=CC3=C(C=C2)C(=CN=C3N=C(N)N)Cl

Isomeric SMILES

CN(C)CCNC(=O)C1CCCN1S(=O)(=O)C2=CC3=C(C=C2)C(=CN=C3N=C(N)N)Cl

InChI

InChI=1S/C19H26ClN7O3S/c1-26(2)9-7-23-18(28)16-4-3-8-27(16)31(29,30)12-5-6-13-14(10-12)17(25-19(21)22)24-11-15(13)20/h5-6,10-11,16H,3-4,7-9H2,1-2H3,(H,23,28)(H4,21,22,24,25)