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

Systemtic Name: 1-[(Z)-[(1S)-1-morpholin-4-yl-1-phenyl-propan-2-ylidene]amino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(Z)-[(2S)-1-methyl-2-morpholino-2-phenyl-ethylidene]amino]thiourea CAS Name: 1-[(Z)-[(1S)-1-(4-morpholinyl)-1-phenylpropan-2-ylidene]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(Z)-[(1S)-1-morpholin-4-yl-1-phenylpropan-2-ylidene]amino]thiourea Traditional Name: 1-benzyl-3-[(Z)-[(2S)-1-methyl-2-morpholino-2-phenyl-ethylidene]amino]thiourea Formula: C21H26N4OS MolecularWeight: 382.52234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC1=CC=CC=C1)C(C2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

C/C(=N/NC(=S)NCC1=CC=CC=C1)/[C@H](C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C21H26N4OS/c1-17(23-24-21(27)22-16-18-8-4-2-5-9-18)20(19-10-6-3-7-11-19)25-12-14-26-15-13-25/h2-11,20H,12-16H2,1H3,(H2,22,24,27)/b23-17-/t20-/m1/s1