N-(2-methyl-6-propan-2-yl-phenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethanamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-[4-(3-thienylmethyl)piperazin-1-yl]acetamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-2-[4-(3-thiophenylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]acetamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-[4-(3-thenyl)piperazino]acetamide Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)CN2CCN(CC2)CC3=CSC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)CN2CCN(CC2)CC3=CSC=C3

InChI

InChI=1S/C21H29N3OS/c1-16(2)19-6-4-5-17(3)21(19)22-20(25)14-24-10-8-23(9-11-24)13-18-7-12-26-15-18/h4-7,12,15-16H,8-11,13-14H2,1-3H3,(H,22,25)