(6E)-6-[4-[(2-azanyl-3-oxidanyl-propyl)amino]-1H-quinazolin-2-ylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[4-[(2-azanyl-3-oxidanyl-propyl)amino]-1H-quinazolin-2-ylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[4-[(2-amino-3-hydroxy-propyl)amino]-1H-quinazolin-2-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[4-[(2-amino-3-hydroxypropyl)amino]-1H-quinazolin-2-ylidene]-4-chloro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[4-[(2-amino-3-hydroxypropyl)amino]-1H-quinazolin-2-ylidene]-4-chlorocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[4-[(2-amino-3-hydroxy-propyl)amino]-1H-quinazolin-2-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one Formula: C17H17ClN4O2 MolecularWeight: 344.79548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=C3C=C(C=CC3=O)Cl)N2)NCC(CO)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=N/C(=C/3\C=C(C=CC3=O)Cl)/N2)NCC(CO)N

InChI

InChI=1S/C17H17ClN4O2/c18-10-5-6-15(24)13(7-10)17-21-14-4-2-1-3-12(14)16(22-17)20-8-11(19)9-23/h1-7,11,21,23H,8-9,19H2,(H,20,22)/b17-13+