1-(2-methoxyphenyl)-3-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]amino]thiourea

Systemtic Name: 1-(2-methoxyphenyl)-3-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]amino]thiourea Openeye Name: 1-(2-methoxyphenyl)-3-[(Z)-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]amino]thiourea CAS Name: 1-(2-methoxyphenyl)-3-[(Z)-[(1S)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-ylidene]amino]thiourea IUPAC Name: 1-(2-methoxyphenyl)-3-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-ylidene]amino]thiourea Traditional Name: 1-(2-methoxyphenyl)-3-[(Z)-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]amino]thiourea Formula: C21H27N4O2S+ MolecularWeight: 399.52968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC=CC=C1OC)C(C2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

C/C(=N/NC(=S)NC1=CC=CC=C1OC)/[C@H](C2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C21H26N4O2S/c1-16(23-24-21(28)22-18-10-6-7-11-19(18)26-2)20(17-8-4-3-5-9-17)25-12-14-27-15-13-25/h3-11,20H,12-15H2,1-2H3,(H2,22,24,28)/p+1/b23-16-/t20-/m1/s1