1-[4-[(2S)-butan-2-yl]phenyl]-3-(3-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[4-[(2S)-butan-2-yl]phenyl]-3-(3-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-[4-[(1S)-1-methylpropyl]phenyl]-3-(3-morpholinosulfonylphenyl)thiourea CAS Name: 1-[4-[(2S)-butan-2-yl]phenyl]-3-[3-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[4-[(2S)-butan-2-yl]phenyl]-3-(3-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-[4-[(1S)-1-methylpropyl]phenyl]-3-(3-morpholinosulfonylphenyl)thiourea Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H27N3O3S2/c1-3-16(2)17-7-9-18(10-8-17)22-21(28)23-19-5-4-6-20(15-19)29(25,26)24-11-13-27-14-12-24/h4-10,15-16H,3,11-14H2,1-2H3,(H2,22,23,28)/t16-/m0/s1