1-(4-methoxyphenyl)-3-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]thiourea Openeye Name: 1-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-(4-methoxyphenyl)-3-[[(2S)-4-(phenylmethyl)-2-morpholin-4-iumyl]methyl]thiourea IUPAC Name: 1-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-3-(4-methoxyphenyl)thiourea Formula: C20H26N3O2S+ MolecularWeight: 372.50434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCC2C[NH+](CCO2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NC[C@H]2C[NH+](CCO2)CC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O2S/c1-24-18-9-7-17(8-10-18)22-20(26)21-13-19-15-23(11-12-25-19)14-16-5-3-2-4-6-16/h2-10,19H,11-15H2,1H3,(H2,21,22,26)/p+1/t19-/m0/s1