1-[2-(5-chloranyl-2-methyl-1H-indol-3-yl)ethyl]-3-(2,6-diethylphenyl)thiourea

Systemtic Name: 1-[2-(5-chloranyl-2-methyl-1H-indol-3-yl)ethyl]-3-(2,6-diethylphenyl)thiourea Openeye Name: 1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-3-(2,6-diethylphenyl)thiourea CAS Name: 1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-3-(2,6-diethylphenyl)thiourea IUPAC Name: 1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-3-(2,6-diethylphenyl)thiourea Traditional Name: 1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-3-(2,6-diethylphenyl)thiourea Formula: C22H26ClN3S MolecularWeight: 399.97994

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NCCC2=C(NC3=C2C=C(C=C3)Cl)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NCCC2=C(NC3=C2C=C(C=C3)Cl)C

InChI

InChI=1S/C22H26ClN3S/c1-4-15-7-6-8-16(5-2)21(15)26-22(27)24-12-11-18-14(3)25-20-10-9-17(23)13-19(18)20/h6-10,13,25H,4-5,11-12H2,1-3H3,(H2,24,26,27)