N5-methyl-N5-(thiolan-3-yl)isoquinoline-5,8-diamine

Systemtic Name: N5-methyl-N5-(thiolan-3-yl)isoquinoline-5,8-diamine Openeye Name: N5-methyl-N5-tetrahydrothiophen-3-yl-isoquinoline-5,8-diamine CAS Name: N5-methyl-N5-(3-thiolanyl)isoquinoline-5,8-diamine IUPAC Name: 5-N-methyl-5-N-(thiolan-3-yl)isoquinoline-5,8-diamine Traditional Name: (8-amino-5-isoquinolyl)-methyl-tetrahydrothiophen-3-yl-amine Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCSC1)C2=C3C=CN=CC3=C(C=C2)N

Isomeric SMILES

CN(C1CCSC1)C2=C3C=CN=CC3=C(C=C2)N

InChI

InChI=1S/C14H17N3S/c1-17(10-5-7-18-9-10)14-3-2-13(15)12-8-16-6-4-11(12)14/h2-4,6,8,10H,5,7,9,15H2,1H3