2-[1-[2-(1,3-benzothiazol-2-yl)hydrazinyl]-3-methyl-butylidene]indene-1,3-dione

Systemtic Name: 2-[1-[2-(1,3-benzothiazol-2-yl)hydrazinyl]-3-methyl-butylidene]indene-1,3-dione Openeye Name: 2-[1-[2-(1,3-benzothiazol-2-yl)hydrazino]-3-methyl-butylidene]indane-1,3-dione CAS Name: 2-[1-(1,3-benzothiazol-2-ylhydrazo)-3-methylbutylidene]indene-1,3-dione IUPAC Name: 2-[1-[2-(1,3-benzothiazol-2-yl)hydrazinyl]-3-methylbutylidene]indene-1,3-dione Traditional Name: 2-[1-[N'-(1,3-benzothiazol-2-yl)hydrazino]-3-methyl-butylidene]indane-1,3-quinone Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=C1C(=O)C2=CC=CC=C2C1=O)NNC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)CC(=C1C(=O)C2=CC=CC=C2C1=O)NNC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3O2S/c1-12(2)11-16(18-19(25)13-7-3-4-8-14(13)20(18)26)23-24-21-22-15-9-5-6-10-17(15)27-21/h3-10,12,23H,11H2,1-2H3,(H,22,24)