1-[(2S)-1-methoxypropan-2-yl]-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea

Systemtic Name: 1-[(2S)-1-methoxypropan-2-yl]-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea Openeye Name: 1-[(1S)-2-methoxy-1-methyl-ethyl]-3-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]thiourea CAS Name: 1-[(2S)-1-methoxypropan-2-yl]-3-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]thiourea IUPAC Name: 1-[(2S)-1-methoxypropan-2-yl]-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)thiourea Traditional Name: 1-[(1S)-2-methoxy-1-methyl-ethyl]-3-(5-morpholinosulfonyl-2-piperidino-phenyl)thiourea Formula: C20H32N4O4S2 MolecularWeight: 456.62248

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCCC3

Isomeric SMILES

C[C@@H](COC)NC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCCC3

InChI

InChI=1S/C20H32N4O4S2/c1-16(15-27-2)21-20(29)22-18-14-17(30(25,26)24-10-12-28-13-11-24)6-7-19(18)23-8-4-3-5-9-23/h6-7,14,16H,3-5,8-13,15H2,1-2H3,(H2,21,22,29)/t16-/m0/s1