1-[2-[(2S)-butan-2-yl]phenyl]-3-[2-(5-methoxy-1H-indol-3-yl)ethyl]thiourea

Systemtic Name: 1-[2-[(2S)-butan-2-yl]phenyl]-3-[2-(5-methoxy-1H-indol-3-yl)ethyl]thiourea Openeye Name: 1-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-[2-[(1S)-1-methylpropyl]phenyl]thiourea CAS Name: 1-[2-[(2S)-butan-2-yl]phenyl]-3-[2-(5-methoxy-1H-indol-3-yl)ethyl]thiourea IUPAC Name: 1-[2-[(2S)-butan-2-yl]phenyl]-3-[2-(5-methoxy-1H-indol-3-yl)ethyl]thiourea Traditional Name: 1-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-[2-[(1S)-1-methylpropyl]phenyl]thiourea Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=S)NCCC2=CNC3=C2C=C(C=C3)OC

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1NC(=S)NCCC2=CNC3=C2C=C(C=C3)OC

InChI

InChI=1S/C22H27N3OS/c1-4-15(2)18-7-5-6-8-21(18)25-22(27)23-12-11-16-14-24-20-10-9-17(26-3)13-19(16)20/h5-10,13-15,24H,4,11-12H2,1-3H3,(H2,23,25,27)/t15-/m0/s1