ethyl 2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-oxidanylidene-indazole-1-carboxylate

Systemtic Name: ethyl 2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-oxidanylidene-indazole-1-carboxylate Openeye Name: ethyl 2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-oxo-indazole-1-carboxylate CAS Name: 2-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-3-oxo-1-indazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-oxoindazole-1-carboxylate Traditional Name: 2-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl]-3-keto-indazoline-1-carboxylic acid ethyl ester Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=CC=CC=C2C(=O)N1CCCCN3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)N1C2=CC=CC=C2C(=O)N1CCCCN3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C25H29N5O3S/c1-2-33-25(32)30-21-11-5-3-9-19(21)24(31)29(30)14-8-7-13-27-15-17-28(18-16-27)23-20-10-4-6-12-22(20)34-26-23/h3-6,9-12H,2,7-8,13-18H2,1H3