3-[3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propoxy]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propoxy]-1,2,3-benzotriazin-4-one Openeye Name: 3-[3-[4-(2-thienylmethyl)piperazin-1-yl]propoxy]-1,2,3-benzotriazin-4-one CAS Name: 3-[3-[4-(thiophen-2-ylmethyl)-1-piperazinyl]propoxy]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propoxy]-1,2,3-benzotriazin-4-one Traditional Name: 3-[3-[4-(2-thenyl)piperazino]propoxy]-1,2,3-benzotriazin-4-one Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCON2C(=O)C3=CC=CC=C3N=N2)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN1CCCON2C(=O)C3=CC=CC=C3N=N2)CC4=CC=CS4

InChI

InChI=1S/C19H23N5O2S/c25-19-17-6-1-2-7-18(17)20-21-24(19)26-13-4-8-22-9-11-23(12-10-22)15-16-5-3-14-27-16/h1-3,5-7,14H,4,8-13,15H2