1-tert-butyl-3-[3-(tert-butylcarbamothioylamino)-6-phenyl-phenanthridin-8-yl]thiourea

Systemtic Name: 1-tert-butyl-3-[3-(tert-butylcarbamothioylamino)-6-phenyl-phenanthridin-8-yl]thiourea Openeye Name: 1-tert-butyl-3-[3-(tert-butylcarbamothioylamino)-6-phenyl-phenanthridin-8-yl]thiourea CAS Name: 1-tert-butyl-3-[3-[[(tert-butylamino)-sulfanylidenemethyl]amino]-6-phenyl-8-phenanthridinyl]thiourea IUPAC Name: 1-tert-butyl-3-[3-(tert-butylcarbamothioylamino)-6-phenylphenanthridin-8-yl]thiourea Traditional Name: 1-tert-butyl-3-[3-(tert-butylthiocarbamoylamino)-6-phenyl-phenanthridin-8-yl]thiourea Formula: C29H33N5S2 MolecularWeight: 515.73582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC1=CC2=C(N=C3C=C(C=CC3=C2C=C1)NC(=S)NC(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)NC(=S)NC1=CC2=C(N=C3C=C(C=CC3=C2C=C1)NC(=S)NC(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C29H33N5S2/c1-28(2,3)33-26(35)30-19-12-14-21-22-15-13-20(31-27(36)34-29(4,5)6)17-24(22)32-25(23(21)16-19)18-10-8-7-9-11-18/h7-17H,1-6H3,(H2,30,33,35)(H2,31,34,36)