4-thiophen-3-yl-2-[[4-[1-(1,2,4-triazol-1-yl)ethyl]phenyl]amino]pyrimidine-5-carbonitrile

Systemtic Name: 4-thiophen-3-yl-2-[[4-[1-(1,2,4-triazol-1-yl)ethyl]phenyl]amino]pyrimidine-5-carbonitrile Openeye Name: 4-(3-thienyl)-2-[4-[1-(1,2,4-triazol-1-yl)ethyl]anilino]pyrimidine-5-carbonitrile CAS Name: 4-(3-thiophenyl)-2-[4-[1-(1,2,4-triazol-1-yl)ethyl]anilino]-5-pyrimidinecarbonitrile IUPAC Name: 4-thiophen-3-yl-2-[4-[1-(1,2,4-triazol-1-yl)ethyl]anilino]pyrimidine-5-carbonitrile Traditional Name: 4-(3-thienyl)-2-[4-[1-(1,2,4-triazol-1-yl)ethyl]anilino]pyrimidine-5-carbonitrile Formula: C19H15N7S MolecularWeight: 373.4343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC2=NC=C(C(=N2)C3=CSC=C3)C#N)N4C=NC=N4

Isomeric SMILES

CC(C1=CC=C(C=C1)NC2=NC=C(C(=N2)C3=CSC=C3)C#N)N4C=NC=N4

InChI

InChI=1S/C19H15N7S/c1-13(26-12-21-11-23-26)14-2-4-17(5-3-14)24-19-22-9-16(8-20)18(25-19)15-6-7-27-10-15/h2-7,9-13H,1H3,(H,22,24,25)