[1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]-(4-ethylpiperazin-1-yl)methanone

Systemtic Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]-(4-ethylpiperazin-1-yl)methanone Openeye Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidyl]-(4-ethylpiperazin-1-yl)methanone CAS Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidinyl]-(4-ethyl-1-piperazinyl)methanone IUPAC Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]-(4-ethylpiperazin-1-yl)methanone Traditional Name: [1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidyl]-(4-ethylpiperazino)methanone Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2CCCN(C2)C3=NC4=C(S3)C=C(C=C4)OCC

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2CCCN(C2)C3=NC4=C(S3)C=C(C=C4)OCC

InChI

InChI=1S/C21H30N4O2S/c1-3-23-10-12-24(13-11-23)20(26)16-6-5-9-25(15-16)21-22-18-8-7-17(27-4-2)14-19(18)28-21/h7-8,14,16H,3-6,9-13,15H2,1-2H3