sodium (Z)-[5-chloranyl-1-[3-(dimethylamino)propylcarbamoyl]-2-oxidanylidene-indol-3-ylidene]-thiophen-2-yl-methanolate

Systemtic Name: sodium (Z)-[5-chloranyl-1-[3-(dimethylamino)propylcarbamoyl]-2-oxidanylidene-indol-3-ylidene]-thiophen-2-yl-methanolate Openeye Name: sodium (Z)-[5-chloro-1-[3-(dimethylamino)propylcarbamoyl]-2-oxo-indolin-3-ylidene]-(2-thienyl)methanolate CAS Name: sodium (Z)-[5-chloro-1-[[3-(dimethylamino)propylamino]-oxomethyl]-2-oxo-3-indolylidene]-thiophen-2-ylmethanolate IUPAC Name: sodium (Z)-[5-chloro-1-[3-(dimethylamino)propylcarbamoyl]-2-oxoindol-3-ylidene]-thiophen-2-ylmethanolate Traditional Name: sodium (Z)-[5-chloro-1-[3-(dimethylamino)propylcarbamoyl]-2-keto-indolin-3-ylidene]-(2-thienyl)methanolate Formula: C19H19ClN3NaO3S MolecularWeight: 429.872772

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)N1C2=C(C=C(C=C2)Cl)C(=C(C3=CC=CS3)[O-])C1=O.[Na+]

Isomeric SMILES

CN(C)CCCNC(=O)N1C2=C(C=C(C=C2)Cl)/C(=[14C](\C3=CC=CS3)/[O-])/C1=O.[Na+]

InChI

InChI=1S/C19H20ClN3O3S.Na/c1-22(2)9-4-8-21-19(26)23-14-7-6-12(20)11-13(14)16(18(23)25)17(24)15-5-3-10-27-15;/h3,5-7,10-11,24H,4,8-9H2,1-2H3,(H,21,26);/q;+1/p-1/b17-16-;/i17+2;