N-[4-[4-[bis(2-chloroethyl)amino]phenyl]sulfonylbutyl]acridin-9-amine

Systemtic Name: N-[4-[4-[bis(2-chloroethyl)amino]phenyl]sulfonylbutyl]acridin-9-amine Openeye Name: N-[4-[4-[bis(2-chloroethyl)amino]phenyl]sulfonylbutyl]acridin-9-amine CAS Name: N-[4-[4-[bis(2-chloroethyl)amino]phenyl]sulfonylbutyl]-9-acridinamine IUPAC Name: N-[4-[4-[bis(2-chloroethyl)amino]phenyl]sulfonylbutyl]acridin-9-amine Traditional Name: [4-[4-(acridin-9-ylamino)butylsulfonyl]phenyl]-bis(2-chloroethyl)amine Formula: C27H29Cl2N3O2S MolecularWeight: 530.50906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCS(=O)(=O)C4=CC=C(C=C4)N(CCCl)CCCl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCS(=O)(=O)C4=CC=C(C=C4)N(CCCl)CCCl

InChI

InChI=1S/C27H29Cl2N3O2S/c28-15-18-32(19-16-29)21-11-13-22(14-12-21)35(33,34)20-6-5-17-30-27-23-7-1-3-9-25(23)31-26-10-4-2-8-24(26)27/h1-4,7-14H,5-6,15-20H2,(H,30,31)