ethyl N-[2-azanyl-4-[[5-(dimethylamino)-3-methyl-1-benzothiophen-2-yl]methylamino]phenyl]carbamate

Systemtic Name: ethyl N-[2-azanyl-4-[[5-(dimethylamino)-3-methyl-1-benzothiophen-2-yl]methylamino]phenyl]carbamate Openeye Name: ethyl N-[2-amino-4-[[5-(dimethylamino)-3-methyl-benzothiophen-2-yl]methylamino]phenyl]carbamate CAS Name: N-[2-amino-4-[[5-(dimethylamino)-3-methyl-1-benzothiophen-2-yl]methylamino]phenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-amino-4-[[5-(dimethylamino)-3-methyl-1-benzothiophen-2-yl]methylamino]phenyl]carbamate Traditional Name: N-[2-amino-4-[[5-(dimethylamino)-3-methyl-benzothiophen-2-yl]methylamino]phenyl]carbamic acid ethyl ester Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=C(C=C(C=C1)NCC2=C(C3=C(S2)C=CC(=C3)N(C)C)C)N

Isomeric SMILES

CCOC(=O)NC1=C(C=C(C=C1)NCC2=C(C3=C(S2)C=CC(=C3)N(C)C)C)N

InChI

InChI=1S/C21H26N4O2S/c1-5-27-21(26)24-18-8-6-14(10-17(18)22)23-12-20-13(2)16-11-15(25(3)4)7-9-19(16)28-20/h6-11,23H,5,12,22H2,1-4H3,(H,24,26)