5-[bis(azanyl)methylideneamino]-N-cyclopropyl-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]pentanamide

Systemtic Name: 5-[bis(azanyl)methylideneamino]-N-cyclopropyl-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]pentanamide Openeye Name: N-cyclopropyl-2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-5-guanidino-pentanamide CAS Name: N-cyclopropyl-5-(diaminomethylideneamino)-2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]pentanamide IUPAC Name: N-cyclopropyl-5-(diaminomethylideneamino)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]pentanamide Traditional Name: N-cyclopropyl-5-guanidino-2-(naphthionylamino)valeramide Formula: C21H30N6O3S MolecularWeight: 446.5663

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CCCN=C(N)N)C(=O)NC3CC3

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CCCN=C(N)N)C(=O)NC3CC3

InChI

InChI=1S/C21H30N6O3S/c1-27(2)18-9-3-7-16-15(18)6-4-10-19(16)31(29,30)26-17(8-5-13-24-21(22)23)20(28)25-14-11-12-14/h3-4,6-7,9-10,14,17,26H,5,8,11-13H2,1-2H3,(H,25,28)(H4,22,23,24)