4-[2-[4-(1H-pyrrol-2-yl)butoxy]phenyl]sulfanylbenzene-1,2-diamine

Systemtic Name: 4-[2-[4-(1H-pyrrol-2-yl)butoxy]phenyl]sulfanylbenzene-1,2-diamine Openeye Name: 4-[2-[4-(1H-pyrrol-2-yl)butoxy]phenyl]sulfanylbenzene-1,2-diamine CAS Name: 4-[[2-[4-(1H-pyrrol-2-yl)butoxy]phenyl]thio]benzene-1,2-diamine IUPAC Name: 4-[2-[4-(1H-pyrrol-2-yl)butoxy]phenyl]sulfanylbenzene-1,2-diamine Traditional Name: [2-amino-4-[[2-[4-(1H-pyrrol-2-yl)butoxy]phenyl]thio]phenyl]amine Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCCCC2=CC=CN2)SC3=CC(=C(C=C3)N)N

Isomeric SMILES

C1=CC=C(C(=C1)OCCCCC2=CC=CN2)SC3=CC(=C(C=C3)N)N

InChI

InChI=1S/C20H23N3OS/c21-17-11-10-16(14-18(17)22)25-20-9-2-1-8-19(20)24-13-4-3-6-15-7-5-12-23-15/h1-2,5,7-12,14,23H,3-4,6,13,21-22H2