1-(3,4-dimethylphenyl)-3-[(1-naphthalen-2-ylsulfonylpiperidin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[(1-naphthalen-2-ylsulfonylpiperidin-4-yl)carbonylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[[1-(2-naphthylsulfonyl)piperidine-4-carbonyl]amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[[1-(2-naphthalenylsulfonyl)-4-piperidinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[(1-naphthalen-2-ylsulfonylpiperidine-4-carbonyl)amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[[1-(2-naphthylsulfonyl)isonipecotoyl]amino]thiourea Formula: C25H28N4O3S2 MolecularWeight: 496.64482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C25H28N4O3S2/c1-17-7-9-22(15-18(17)2)26-25(33)28-27-24(30)20-11-13-29(14-12-20)34(31,32)23-10-8-19-5-3-4-6-21(19)16-23/h3-10,15-16,20H,11-14H2,1-2H3,(H,27,30)(H2,26,28,33)