1-(cyclohexylmethyl)-3-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-3-oxidanylidene-4H-quinoxalin-6-yl]thiourea

Systemtic Name: 1-(cyclohexylmethyl)-3-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-3-oxidanylidene-4H-quinoxalin-6-yl]thiourea Openeye Name: 1-(cyclohexylmethyl)-3-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-3-oxo-4H-quinoxalin-6-yl]thiourea CAS Name: 1-(cyclohexylmethyl)-3-[2-(1-methyl-3-pyrrolo[2,3-b]pyridinyl)-3-oxo-4H-quinoxalin-6-yl]thiourea IUPAC Name: 1-(cyclohexylmethyl)-3-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-3-oxo-4H-quinoxalin-6-yl]thiourea Traditional Name: 1-(cyclohexylmethyl)-3-[3-keto-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-4H-quinoxalin-6-yl]thiourea Formula: C24H26N6OS MolecularWeight: 446.56784

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1N=CC=C2)C3=NC4=C(C=C(C=C4)NC(=S)NCC5CCCCC5)NC3=O

Isomeric SMILES

CN1C=C(C2=C1N=CC=C2)C3=NC4=C(C=C(C=C4)NC(=S)NCC5CCCCC5)NC3=O

InChI

InChI=1S/C24H26N6OS/c1-30-14-18(17-8-5-11-25-22(17)30)21-23(31)29-20-12-16(9-10-19(20)28-21)27-24(32)26-13-15-6-3-2-4-7-15/h5,8-12,14-15H,2-4,6-7,13H2,1H3,(H,29,31)(H2,26,27,32)