N-(5-methyl-1H-pyrazol-3-yl)-2-(phenylsulfanylmethyl)-5,6,7,8-tetrahydroquinazolin-4-amine

Systemtic Name: N-(5-methyl-1H-pyrazol-3-yl)-2-(phenylsulfanylmethyl)-5,6,7,8-tetrahydroquinazolin-4-amine Openeye Name: N-(5-methyl-1H-pyrazol-3-yl)-2-(phenylsulfanylmethyl)-5,6,7,8-tetrahydroquinazolin-4-amine CAS Name: N-(5-methyl-1H-pyrazol-3-yl)-2-[(phenylthio)methyl]-5,6,7,8-tetrahydroquinazolin-4-amine IUPAC Name: N-(5-methyl-1H-pyrazol-3-yl)-2-(phenylsulfanylmethyl)-5,6,7,8-tetrahydroquinazolin-4-amine Traditional Name: (5-methyl-1H-pyrazol-3-yl)-[2-[(phenylthio)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]amine Formula: C19H21N5S MolecularWeight: 351.46854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NC(=NC3=C2CCCC3)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1)NC2=NC(=NC3=C2CCCC3)CSC4=CC=CC=C4

InChI

InChI=1S/C19H21N5S/c1-13-11-17(24-23-13)21-19-15-9-5-6-10-16(15)20-18(22-19)12-25-14-7-3-2-4-8-14/h2-4,7-8,11H,5-6,9-10,12H2,1H3,(H2,20,21,22,23,24)