N'-[2-[(3-bromophenyl)methylamino]-2,3-dihydro-1H-inden-5-yl]-6-sulfanylidene-cyclohexa-1,3-diene-1-carboximidamide

Systemtic Name: N'-[2-[(3-bromophenyl)methylamino]-2,3-dihydro-1H-inden-5-yl]-6-sulfanylidene-cyclohexa-1,3-diene-1-carboximidamide Openeye Name: N'-[2-[(3-bromophenyl)methylamino]indan-5-yl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamidine CAS Name: N'-[2-[(3-bromophenyl)methylamino]-2,3-dihydro-1H-inden-5-yl]-6-sulfanylidene-1-cyclohexa-1,3-dienecarboximidamide IUPAC Name: N'-[2-[(3-bromophenyl)methylamino]-2,3-dihydro-1H-inden-5-yl]-6-sulfanylidenecyclohexa-1,3-diene-1-carboximidamide Traditional Name: N'-[2-[(3-bromobenzyl)amino]indan-5-yl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamidine Formula: C23H22BrN3S MolecularWeight: 452.40988

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C(C1=S)C(=NC2=CC3=C(CC(C3)NCC4=CC(=CC=C4)Br)C=C2)N

Isomeric SMILES

C1C=CC=C(C1=S)C(=NC2=CC3=C(CC(C3)NCC4=CC(=CC=C4)Br)C=C2)N

InChI

InChI=1S/C23H22BrN3S/c24-18-5-3-4-15(10-18)14-26-20-11-16-8-9-19(12-17(16)13-20)27-23(25)21-6-1-2-7-22(21)28/h1-6,8-10,12,20,26H,7,11,13-14H2,(H2,25,27)