1-[[2,3-dimethyl-1-(phenylmethyl)indol-5-yl]carbonylamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[[2,3-dimethyl-1-(phenylmethyl)indol-5-yl]carbonylamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(1-benzyl-2,3-dimethyl-indole-5-carbonyl)amino]thiourea CAS Name: 1-[[[2,3-dimethyl-1-(phenylmethyl)-5-indolyl]-oxomethyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[(1-benzyl-2,3-dimethylindole-5-carbonyl)amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(1-benzyl-2,3-dimethyl-indole-5-carbonyl)amino]thiourea Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)NNC(=S)NCC=C)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)NNC(=S)NCC=C)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H24N4OS/c1-4-12-23-22(28)25-24-21(27)18-10-11-20-19(13-18)15(2)16(3)26(20)14-17-8-6-5-7-9-17/h4-11,13H,1,12,14H2,2-3H3,(H,24,27)(H2,23,25,28)