(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C17H15N5O2S MolecularWeight: 353.3983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)C=CC3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C17H15N5O2S/c18-16-20-14(11-24-15(23)9-8-13-7-4-10-25-13)21-17(22-16)19-12-5-2-1-3-6-12/h1-10H,11H2,(H3,18,19,20,21,22)/b9-8+