1-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]thiourea CAS Name: 1-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-3-prop-2-enylthiourea IUPAC Name: 1-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]thiourea Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=S)NCC=C)C2=CNC3=CC=CC=C32

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=S)NCC=C)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H23N3OS/c1-3-12-22-21(26)24-13-18(15-8-10-16(25-2)11-9-15)19-14-23-20-7-5-4-6-17(19)20/h3-11,14,18,23H,1,12-13H2,2H3,(H2,22,24,26)/t18-/m0/s1