N-(4-tert-butylphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide

Systemtic Name: N-(4-tert-butylphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Openeye Name: N-(4-tert-butylphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide CAS Name: N-(4-tert-butylphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide IUPAC Name: N-(4-tert-butylphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbothioamide Traditional Name: N-(4-tert-butylphenyl)-1,3,4,9-tetrahydro-$b-carboline-2-carbothioamide Formula: C22H25N3S MolecularWeight: 363.519

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=S)N2CCC3=C(C2)NC4=CC=CC=C34

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=S)N2CCC3=C(C2)NC4=CC=CC=C34

InChI

InChI=1S/C22H25N3S/c1-22(2,3)15-8-10-16(11-9-15)23-21(26)25-13-12-18-17-6-4-5-7-19(17)24-20(18)14-25/h4-11,24H,12-14H2,1-3H3,(H,23,26)