1-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-(1H-indol-3-yl)ethyl]-3-methyl-thiourea

Systemtic Name: 1-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-(1H-indol-3-yl)ethyl]-3-methyl-thiourea Openeye Name: 1-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-(1H-indol-3-yl)ethyl]-3-methyl-thiourea CAS Name: 1-[(2S)-2-(4-ethoxy-3-methoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-methylthiourea IUPAC Name: 1-[(2S)-2-(4-ethoxy-3-methoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-methylthiourea Traditional Name: 1-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-(1H-indol-3-yl)ethyl]-3-methyl-thiourea Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CNC(=S)NC)C2=CNC3=CC=CC=C32)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](CNC(=S)NC)C2=CNC3=CC=CC=C32)OC

InChI

InChI=1S/C21H25N3O2S/c1-4-26-19-10-9-14(11-20(19)25-3)16(12-24-21(27)22-2)17-13-23-18-8-6-5-7-15(17)18/h5-11,13,16,23H,4,12H2,1-3H3,(H2,22,24,27)/t16-/m0/s1