1-[(5-bromanyl-2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)amino]-3-(3,5-dimethylphenyl)thiourea

Systemtic Name: 1-[(5-bromanyl-2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)amino]-3-(3,5-dimethylphenyl)thiourea Openeye Name: 1-[(1-allyl-5-bromo-2-oxo-indolin-3-ylidene)amino]-3-(3,5-dimethylphenyl)thiourea CAS Name: 1-[(5-bromo-2-oxo-1-prop-2-enyl-3-indolylidene)amino]-3-(3,5-dimethylphenyl)thiourea IUPAC Name: 1-[(5-bromo-2-oxo-1-prop-2-enylindol-3-ylidene)amino]-3-(3,5-dimethylphenyl)thiourea Traditional Name: 1-[(1-allyl-5-bromo-2-keto-indolin-3-ylidene)amino]-3-(3,5-dimethylphenyl)thiourea Formula: C20H19BrN4OS MolecularWeight: 443.36006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC=C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC=C)C

InChI

InChI=1S/C20H19BrN4OS/c1-4-7-25-17-6-5-14(21)11-16(17)18(19(25)26)23-24-20(27)22-15-9-12(2)8-13(3)10-15/h4-6,8-11H,1,7H2,2-3H3,(H2,22,24,27)