6-[6-azanyl-4-(phenethylamino)-1H-1,3,5-triazin-2-ylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[6-azanyl-4-(phenethylamino)-1H-1,3,5-triazin-2-ylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[6-amino-4-(phenethylamino)-1H-1,3,5-triazin-2-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one CAS Name: 6-[6-amino-4-(phenethylamino)-1H-1,3,5-triazin-2-ylidene]-4-chloro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[6-amino-4-(phenethylamino)-1H-1,3,5-triazin-2-ylidene]-4-chlorocyclohexa-2,4-dien-1-one Traditional Name: 6-[6-amino-4-(phenethylamino)-1H-s-triazin-2-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one Formula: C17H16ClN5O MolecularWeight: 341.79484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC(=C3C=C(C=CC3=O)Cl)NC(=N2)N

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC(=C3C=C(C=CC3=O)Cl)NC(=N2)N

InChI

InChI=1S/C17H16ClN5O/c18-12-6-7-14(24)13(10-12)15-21-16(19)23-17(22-15)20-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H4,19,20,21,22,23)