N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6,7-dimethoxy-quinazolin-4-yl]-3-methyl-3-nitrososulfanyl-butanamide

Systemtic Name: N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6,7-dimethoxy-quinazolin-4-yl]-3-methyl-3-nitrososulfanyl-butanamide Openeye Name: N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-6,7-dimethoxy-quinazolin-4-yl]-3-methyl-3-nitrososulfanyl-butanamide CAS Name: N-[2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-6,7-dimethoxy-4-quinazolinyl]-3-methyl-3-(nitrosothio)butanamide IUPAC Name: N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-yl]-3-methyl-3-nitrososulfanylbutanamide Traditional Name: N-[2-[4-(2-furoyl)piperazino]-6,7-dimethoxy-quinazolin-4-yl]-3-methyl-3-(nitrosothio)butyramide Formula: C24H28N6O6S MolecularWeight: 528.58072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=NC(=NC2=CC(=C(C=C21)OC)OC)N3CCN(CC3)C(=O)C4=CC=CO4)SN=O

Isomeric SMILES

CC(C)(CC(=O)NC1=NC(=NC2=CC(=C(C=C21)OC)OC)N3CCN(CC3)C(=O)C4=CC=CO4)SN=O

InChI

InChI=1S/C24H28N6O6S/c1-24(2,37-28-33)14-20(31)26-21-15-12-18(34-3)19(35-4)13-16(15)25-23(27-21)30-9-7-29(8-10-30)22(32)17-6-5-11-36-17/h5-6,11-13H,7-10,14H2,1-4H3,(H,25,26,27,31)