(2-methylphenyl)-[2-[(1-thiophen-3-ylsulfonylpiperidin-4-yl)methylamino]-1,3-thiazol-5-yl]methanone

Systemtic Name: (2-methylphenyl)-[2-[(1-thiophen-3-ylsulfonylpiperidin-4-yl)methylamino]-1,3-thiazol-5-yl]methanone Openeye Name: o-tolyl-[2-[[1-(3-thienylsulfonyl)-4-piperidyl]methylamino]thiazol-5-yl]methanone CAS Name: (2-methylphenyl)-[2-[[1-(3-thiophenylsulfonyl)-4-piperidinyl]methylamino]-5-thiazolyl]methanone IUPAC Name: (2-methylphenyl)-[2-[(1-thiophen-3-ylsulfonylpiperidin-4-yl)methylamino]-1,3-thiazol-5-yl]methanone Traditional Name: o-tolyl-[2-[[1-(3-thienylsulfonyl)-4-piperidyl]methylamino]thiazol-5-yl]methanone Formula: C21H23N3O3S3 MolecularWeight: 461.62062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NCC3CCN(CC3)S(=O)(=O)C4=CSC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NCC3CCN(CC3)S(=O)(=O)C4=CSC=C4

InChI

InChI=1S/C21H23N3O3S3/c1-15-4-2-3-5-18(15)20(25)19-13-23-21(29-19)22-12-16-6-9-24(10-7-16)30(26,27)17-8-11-28-14-17/h2-5,8,11,13-14,16H,6-7,9-10,12H2,1H3,(H,22,23)