(E)-2-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-3-(4-bromanylthiophen-2-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-3-(4-bromanylthiophen-2-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(4-bromo-2-thienyl)prop-2-enenitrile CAS Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(4-bromo-2-thiophenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(4-bromothiophen-2-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-amino-6-anilino-s-triazin-2-yl)-3-(4-bromo-2-thienyl)acrylonitrile Formula: C16H11BrN6S MolecularWeight: 399.26774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C(=CC3=CC(=CS3)Br)C#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)/C(=C/C3=CC(=CS3)Br)/C#N

InChI

InChI=1S/C16H11BrN6S/c17-11-7-13(24-9-11)6-10(8-18)14-21-15(19)23-16(22-14)20-12-4-2-1-3-5-12/h1-7,9H,(H3,19,20,21,22,23)/b10-6+