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

Systemtic Name: 6-[6-azanyl-4-[(phenylmethyl)amino]-1H-1,3,5-triazin-2-ylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[6-amino-4-(benzylamino)-1H-1,3,5-triazin-2-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one CAS Name: 6-[6-amino-4-[(phenylmethyl)amino]-1H-1,3,5-triazin-2-ylidene]-4-chloro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[6-amino-4-(benzylamino)-1H-1,3,5-triazin-2-ylidene]-4-chlorocyclohexa-2,4-dien-1-one Traditional Name: 6-[6-amino-4-(benzylamino)-1H-s-triazin-2-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one Formula: C16H14ClN5O MolecularWeight: 327.76826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=C3C=C(C=CC3=O)Cl)NC(=N2)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=C3C=C(C=CC3=O)Cl)NC(=N2)N

InChI

InChI=1S/C16H14ClN5O/c17-11-6-7-13(23)12(8-11)14-20-15(18)22-16(21-14)19-9-10-4-2-1-3-5-10/h1-8H,9H2,(H4,18,19,20,21,22)