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

Systemtic Name: 4-[4-(4-pyrrol-1-id-2-ylbutoxy)phenyl]sulfanylbenzene-1,2-diamine Openeye Name: 4-[4-(4-pyrrol-1-id-2-ylbutoxy)phenyl]sulfanylbenzene-1,2-diamine CAS Name: 4-[[4-[4-(2-pyrrol-1-idyl)butoxy]phenyl]thio]benzene-1,2-diamine IUPAC Name: 4-[4-(4-pyrrol-1-id-2-ylbutoxy)phenyl]sulfanylbenzene-1,2-diamine Traditional Name: [2-amino-4-[[4-(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=C[N-]C(=C1)CCCCOC2=CC=C(C=C2)SC3=CC(=C(C=C3)N)N

Isomeric SMILES

C1=C[N-]C(=C1)CCCCOC2=CC=C(C=C2)SC3=CC(=C(C=C3)N)N

InChI

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