N-[(E)-3-methylbut-2-enylideneamino]-6-(phenylmethyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[(E)-3-methylbut-2-enylideneamino]-6-(phenylmethyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-benzyl-N-[(E)-3-methylbut-2-enylideneamino]thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(E)-3-methylbut-2-enylideneamino]-6-(phenylmethyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-benzyl-N-[(E)-3-methylbut-2-enylideneamino]thieno[2,3-d]pyrimidin-4-amine Traditional Name: (6-benzylthieno[2,3-d]pyrimidin-4-yl)-[(E)-3-methylbut-2-enylideneamino]amine Formula: C18H18N4S MolecularWeight: 322.42732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=NNC1=C2C=C(SC2=NC=N1)CC3=CC=CC=C3)C

Isomeric SMILES

CC(=C/C=N/NC1=C2C=C(SC2=NC=N1)CC3=CC=CC=C3)C

InChI

InChI=1S/C18H18N4S/c1-13(2)8-9-21-22-17-16-11-15(23-18(16)20-12-19-17)10-14-6-4-3-5-7-14/h3-9,11-12H,10H2,1-2H3,(H,19,20,22)/b21-9+