1-[(1-methylindol-3-yl)methyl]-1-(phenylmethyl)-3-(2,4,6-trimethylphenyl)thiourea

Systemtic Name: 1-[(1-methylindol-3-yl)methyl]-1-(phenylmethyl)-3-(2,4,6-trimethylphenyl)thiourea Openeye Name: 1-benzyl-1-[(1-methylindol-3-yl)methyl]-3-(2,4,6-trimethylphenyl)thiourea CAS Name: 1-[(1-methyl-3-indolyl)methyl]-1-(phenylmethyl)-3-(2,4,6-trimethylphenyl)thiourea IUPAC Name: 1-benzyl-1-[(1-methylindol-3-yl)methyl]-3-(2,4,6-trimethylphenyl)thiourea Traditional Name: 1-benzyl-3-mesityl-1-[(1-methylindol-3-yl)methyl]thiourea Formula: C27H29N3S MolecularWeight: 427.60426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)N(CC2=CC=CC=C2)CC3=CN(C4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)N(CC2=CC=CC=C2)CC3=CN(C4=CC=CC=C43)C)C

InChI

InChI=1S/C27H29N3S/c1-19-14-20(2)26(21(3)15-19)28-27(31)30(16-22-10-6-5-7-11-22)18-23-17-29(4)25-13-9-8-12-24(23)25/h5-15,17H,16,18H2,1-4H3,(H,28,31)