1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methyl-thiourea

Systemtic Name: 1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methyl-thiourea Openeye Name: 1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methyl-thiourea CAS Name: 1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylthiourea IUPAC Name: 1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylthiourea Traditional Name: 1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methyl-thiourea Formula: C20H25N3O2S MolecularWeight: 371.4964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)C(=S)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C[C@H](OC2=CC=CC=C21)CN(C)C(=S)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H25N3O2S/c1-4-23-14-17(25-19-8-6-5-7-18(19)23)13-22(2)20(26)21-15-9-11-16(24-3)12-10-15/h5-12,17H,4,13-14H2,1-3H3,(H,21,26)/t17-/m1/s1