1-(3-methoxyphenyl)-3-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-(3-methoxyphenyl)-3-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiourea Openeye Name: 1-(3-methoxyphenyl)-3-[(1-methylsulfonylpiperidine-4-carbonyl)amino]thiourea CAS Name: 1-(3-methoxyphenyl)-3-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-methoxyphenyl)-3-[(1-methylsulfonylpiperidine-4-carbonyl)amino]thiourea Traditional Name: 1-[(1-mesylisonipecotoyl)amino]-3-(3-methoxyphenyl)thiourea Formula: C15H22N4O4S2 MolecularWeight: 386.48958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C15H22N4O4S2/c1-23-13-5-3-4-12(10-13)16-15(24)18-17-14(20)11-6-8-19(9-7-11)25(2,21)22/h3-5,10-11H,6-9H2,1-2H3,(H,17,20)(H2,16,18,24)