4-[3-(4-pyrrol-1-id-2-ylbutoxy)phenyl]sulfanylbenzene-1,2-diamine

Systemtic Name: 4-[3-(4-pyrrol-1-id-2-ylbutoxy)phenyl]sulfanylbenzene-1,2-diamine Openeye Name: 4-[3-(4-pyrrol-1-id-2-ylbutoxy)phenyl]sulfanylbenzene-1,2-diamine CAS Name: 4-[[3-[4-(2-pyrrol-1-idyl)butoxy]phenyl]thio]benzene-1,2-diamine IUPAC Name: 4-[3-(4-pyrrol-1-id-2-ylbutoxy)phenyl]sulfanylbenzene-1,2-diamine Traditional Name: [2-amino-4-[[3-(4-pyrrol-1-id-2-ylbutoxy)phenyl]thio]phenyl]amine Formula: C20H22N3OS- MolecularWeight: 352.47318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=CC(=C(C=C2)N)N)OCCCCC3=CC=C[N-]3

Isomeric SMILES

C1=CC(=CC(=C1)SC2=CC(=C(C=C2)N)N)OCCCCC3=CC=C[N-]3

InChI

InChI=1S/C20H22N3OS/c21-19-10-9-18(14-20(19)22)25-17-8-3-7-16(13-17)24-12-2-1-5-15-6-4-11-23-15/h3-4,6-11,13-14H,1-2,5,12,21-22H2/q-1