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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl (E)-3-(5-methylthiophen-2-yl)prop-2-enoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl (E)-3-(5-methyl-2-thienyl)prop-2-enoate CAS Name: (E)-3-(5-methyl-2-thiophenyl)-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-(5-methylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-methyl-2-thienyl)acrylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H17N5O2S/c1-12-7-8-14(26-12)9-10-16(24)25-11-15-21-17(19)23-18(22-15)20-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H3,19,20,21,22,23)/b10-9+