1-azanyl-5-(3,4,5-trimethoxyphenyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carbonitrile

Systemtic Name: 1-azanyl-5-(3,4,5-trimethoxyphenyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carbonitrile Openeye Name: 1-amino-5-(3,4,5-trimethoxyphenyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carbonitrile CAS Name: 1-amino-5-(3,4,5-trimethoxyphenyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carbonitrile IUPAC Name: 1-amino-5-(3,4,5-trimethoxyphenyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carbonitrile Traditional Name: 1-amino-5-(3,4,5-trimethoxyphenyl)-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carbonitrile Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C3CCCCC3=C4C(=C(SC4=N2)C#N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C3CCCCC3=C4C(=C(SC4=N2)C#N)N

InChI

InChI=1S/C21H21N3O3S/c1-25-14-8-11(9-15(26-2)20(14)27-3)19-13-7-5-4-6-12(13)17-18(23)16(10-22)28-21(17)24-19/h8-9H,4-7,23H2,1-3H3