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

Systemtic Name: 4-[4-(3-pyrrol-1-id-2-ylbutan-2-yloxy)phenyl]sulfanylbenzene-1,2-diamine Openeye Name: 4-[4-(1-methyl-2-pyrrol-1-id-2-yl-propoxy)phenyl]sulfanylbenzene-1,2-diamine CAS Name: 4-[[4-[3-(2-pyrrol-1-idyl)butan-2-yloxy]phenyl]thio]benzene-1,2-diamine IUPAC Name: 4-[4-(3-pyrrol-1-id-2-ylbutan-2-yloxy)phenyl]sulfanylbenzene-1,2-diamine Traditional Name: [2-amino-4-[[4-(1-methyl-2-pyrrol-1-id-2-yl-propoxy)phenyl]thio]phenyl]amine Formula: C20H22N3OS- MolecularWeight: 352.47318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C[N-]1)C(C)OC2=CC=C(C=C2)SC3=CC(=C(C=C3)N)N

Isomeric SMILES

CC(C1=CC=C[N-]1)C(C)OC2=CC=C(C=C2)SC3=CC(=C(C=C3)N)N

InChI

InChI=1S/C20H22N3OS/c1-13(20-4-3-11-23-20)14(2)24-15-5-7-16(8-6-15)25-17-9-10-18(21)19(22)12-17/h3-14H,21-22H2,1-2H3/q-1