N-[4-[(4,5-dimethylacridin-9-yl)amino]phenyl]-4-(1,3-thiazinan-2-ylamino)butane-1-sulfonamide

Systemtic Name: N-[4-[(4,5-dimethylacridin-9-yl)amino]phenyl]-4-(1,3-thiazinan-2-ylamino)butane-1-sulfonamide Openeye Name: N-[4-[(4,5-dimethylacridin-9-yl)amino]phenyl]-4-(1,3-thiazinan-2-ylamino)butane-1-sulfonamide CAS Name: N-[4-[(4,5-dimethyl-9-acridinyl)amino]phenyl]-4-(1,3-thiazinan-2-ylamino)-1-butanesulfonamide IUPAC Name: N-[4-[(4,5-dimethylacridin-9-yl)amino]phenyl]-4-(1,3-thiazinan-2-ylamino)butane-1-sulfonamide Traditional Name: N-[4-[(4,5-dimethylacridin-9-yl)amino]phenyl]-4-(1,3-thiazinan-2-ylamino)butane-1-sulfonamide Formula: C29H35N5O2S2 MolecularWeight: 549.7505

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C3C(=CC=CC3=C2NC4=CC=C(C=C4)NS(=O)(=O)CCCCNC5NCCCS5)C

Isomeric SMILES

CC1=CC=CC2=C1N=C3C(=CC=CC3=C2NC4=CC=C(C=C4)NS(=O)(=O)CCCCNC5NCCCS5)C

InChI

InChI=1S/C29H35N5O2S2/c1-20-8-5-10-24-26(20)33-27-21(2)9-6-11-25(27)28(24)32-22-12-14-23(15-13-22)34-38(35,36)19-4-3-16-30-29-31-17-7-18-37-29/h5-6,8-15,29-31,34H,3-4,7,16-19H2,1-2H3,(H,32,33)