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

Systemtic Name: 1-[4-[(2S)-butan-2-yl]phenyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[4-[(1S)-1-methylpropyl]phenyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[4-[(2S)-butan-2-yl]phenyl]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[4-[(2S)-butan-2-yl]phenyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[4-[(1S)-1-methylpropyl]phenyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C17H28N3OS+ MolecularWeight: 322.48872

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C17H27N3OS/c1-3-14(2)15-4-6-16(7-5-15)19-17(22)18-8-9-20-10-12-21-13-11-20/h4-7,14H,3,8-13H2,1-2H3,(H2,18,19,22)/p+1/t14-/m0/s1