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

Systemtic Name: 3-(3-chloranyl-2-methyl-phenyl)-1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-1-methyl-thiourea Openeye Name: 3-(3-chloro-2-methyl-phenyl)-1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-1-methyl-thiourea CAS Name: 3-(3-chloro-2-methylphenyl)-1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-1-methylthiourea IUPAC Name: 3-(3-chloro-2-methylphenyl)-1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-1-methylthiourea Traditional Name: 3-(3-chloro-2-methyl-phenyl)-1-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-1-methyl-thiourea Formula: C20H24ClN3OS MolecularWeight: 389.94206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN3OS/c1-4-24-13-15(25-19-11-6-5-10-18(19)24)12-23(3)20(26)22-17-9-7-8-16(21)14(17)2/h5-11,15H,4,12-13H2,1-3H3,(H,22,26)/t15-/m1/s1