1-[(3-bromanyl-5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-[(3-bromanyl-5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-[(3-bromo-5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[(3-bromo-5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-[(3-bromo-5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-[(3-bromo-6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C14H18BrN3O3S MolecularWeight: 388.28002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=CNNC(=S)NCC2CCCO2)C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=CNNC(=S)NC[C@H]2CCCO2)C1=O)Br

InChI

InChI=1S/C14H18BrN3O3S/c1-20-12-6-10(15)5-9(13(12)19)7-17-18-14(22)16-8-11-3-2-4-21-11/h5-7,11,17H,2-4,8H2,1H3,(H2,16,18,22)/t11-/m1/s1