(6-chloranyl-1H-indol-5-yl)-[2,2-dimethyl-4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (6-chloranyl-1H-indol-5-yl)-[2,2-dimethyl-4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: (6-chloro-1H-indol-5-yl)-[2,2-dimethyl-4-(3-thienylmethyl)piperazin-1-yl]methanone CAS Name: (6-chloro-1H-indol-5-yl)-[2,2-dimethyl-4-(3-thiophenylmethyl)-1-piperazinyl]methanone IUPAC Name: (6-chloro-1H-indol-5-yl)-[2,2-dimethyl-4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: (6-chloro-1H-indol-5-yl)-[2,2-dimethyl-4-(3-thenyl)piperazino]methanone Formula: C20H22ClN3OS MolecularWeight: 387.92618

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1C(=O)C2=C(C=C3C(=C2)C=CN3)Cl)CC4=CSC=C4)C

Isomeric SMILES

CC1(CN(CCN1C(=O)C2=C(C=C3C(=C2)C=CN3)Cl)CC4=CSC=C4)C

InChI

InChI=1S/C20H22ClN3OS/c1-20(2)13-23(11-14-4-8-26-12-14)6-7-24(20)19(25)16-9-15-3-5-22-18(15)10-17(16)21/h3-5,8-10,12,22H,6-7,11,13H2,1-2H3